reactant_1_smiles,reactant_2_smiles,catalyst_smiles,ligand_smiles,reagent_1_smiles,solvent_1_smiles,rxn,yield
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.047641092184596195
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Na+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0412096203597114
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0258383665286105
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[OH-].[Na+],CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0444317065372505
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0194987400815928
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0325080927899943
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.862621224841378
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Fe].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.07546079873445011
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.936745145376158
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Fe+2].[Na+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.143214354734956
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0210830716745609
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.17085231062003298
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0315768624811382
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Na+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0475379053091498
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0246181658212302
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Na+].OC([O-])=O,CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.05267140865080169
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0195634116073256
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.033470521471338305
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6922093433688
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Fe].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0510255242912967
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8319063214096271
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Fe+2].[Na+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.13680381672727399
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0182471592243866
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.10994082002903999
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0178675303928125
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Cs+].[F-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0435920116829955
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0270970319261194
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[F-].[Cs+],CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0648652823683892
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0210068590036068
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0332272956618858
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6844400164755391
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Cs+].[F-].[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.058381001733826106
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.730197105076637
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Cs+].[F-].[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.131958561281243
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0210098201074023
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.10218888659788
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.030040038893554798
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.047313701172475
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.025779797728445
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.058267255162714
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0188178466778928
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0368610190848114
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.533442477399675
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[Fe].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0580499299101468
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.606695362355924
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[Fe+2].[K+].[K+].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.143933392770758
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0226866296700559
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.10000309589551801
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.055969019412474
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[K+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.04821961014500881
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0248590898286748
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[OH-],CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0645624672939622
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0205952841211658
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0321864784308256
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7841742281936681
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Fe].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.08939774440857329
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9222423864659519
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Fe+2].[K+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.142206754932286
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.023455596596732
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.181597678162321
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.070788779533304
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Li+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.054483808696152
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.019905488811482498
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Li+].[O-]C(C)(C)C,CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0608313547812363
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0245280550760324
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0356636244233208
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.857734226150222
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Fe].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0978109907191012
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.928344072930483
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Fe+2].[Li+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.15410461843799
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0242654830002009
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.17175903884481902
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0782316946168684
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0614029657993896
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0213374309510393
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,CCN(CC)CC,CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0505213723181808
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0198028622008522
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.04468078247013971
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.78957919561643
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0699621084980946
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.903017535211921
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.153607442237364
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.025092799414433903
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.195108844387778
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0975908286686094
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0415312486926772
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.015322361176908801
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,,CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0579692311337673
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0264661537803254
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0442903768983828
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6680414267753351
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0642130859194569
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.782264541946686
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.13954011325243798
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.021103931503683
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0828740356846637
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.337884226000348
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Na+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.08083894061744809
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.612000810462792
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[OH-].[Na+],C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.699420492553848
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.072041205533469
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7946758861972999
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.870599138552419
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Fe].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.127035086532037
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.88966679030845
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Fe+2].[Na+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.279254607314512
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.061056671566937004
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.199964908124804
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6673580436757889
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Na+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0811170620285451
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5748441781192191
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Na+].OC([O-])=O,C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.618864221022104
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.022298455248819602
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7045487800303429
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.798467095458273
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Fe].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.09599426469894351
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8076770744439
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Fe+2].[Na+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.19243178629042698
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.051969197906547304
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0833159713932573
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.39169224224222904
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Cs+].[F-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0724196612769955
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.449830827378729
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[F-].[Cs+],C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.509504664551199
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0222798897357048
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6129229271625181
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6082558869673089
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Cs+].[F-].[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.09943556627112321
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.535151293766415
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Cs+].[F-].[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.18181558325170802
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0368200738399539
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0841663218738277
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.41234218800414096
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0665750525584473
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.330190433761406
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.500570187984233
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0267563431152105
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.558517248007788
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.479422368676178
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[Fe].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.093691441148368
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.523254982462699
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[Fe+2].[K+].[K+].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.201771290379512
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0424818416198782
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.07975817476458989
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.48561140726650104
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[K+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.07771747709471401
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.427329765527711
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[OH-],C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.550785260954863
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0303273678853182
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.623266043134165
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.733055406932652
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Fe].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.123022393545058
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.720008032847844
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Fe+2].[K+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.261379482896069
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0454255057271249
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.178334601652192
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.661567482939123
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Li+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.09919387953604289
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.585147171501637
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.78151358455536
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.051213615791615805
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.620179115853534
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.859474312367647
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Fe].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.139143476624983
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.852124687491059
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Fe+2].[Li+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.268267891505492
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.353664697718892
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6872229767603381
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.10159502761028101
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.48803204306713505
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,CCN(CC)CC,C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.826474738914186
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.059704378754713
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8074414530730689
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.878200709579917
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.135554979726139
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.889252912767351
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.216492415106935
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0363674229125296
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.14667841578704802
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.675734596649153
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0943637372825409
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6455832868396401
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,,C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.739667254408659
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0481262088058821
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8361894523916711
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8916720838136579
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.10969547025602899
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.913485106189053
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.21872895631487002
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.045726615404259506
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.115267206773054
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.173301256176142
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Na+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.06271556888171731
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0533782869968364
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[OH-].[Na+],CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.12740444931530098
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0537201523252886
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.08599204025398009
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7784889125449941
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Fe].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.100341310578617
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.882753685705748
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Fe+2].[Na+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.138715355750171
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0479652923515851
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0831483573997866
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0349558510672879
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Na+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0683848609348724
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0253680423569808
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Na+].OC([O-])=O,CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.10591735254912
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.011874456104086798
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0785287792876654
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.421325982495637
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Fe].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0681416606240708
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.370149598879938
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Fe+2].[Na+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.16239544825249103
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0529566936703616
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.012208239311826099
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Cs+].[F-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.062364999079641506
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0424741026607013
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[F-].[Cs+],CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.425433025739575
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.010494159569143999
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.128923037782901
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.638780654995044
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Cs+].[F-].[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.08669773408928601
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.608803891772562
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Cs+].[F-].[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.08669773408928601
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0514533327418496
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.18734702986618199
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0369254079562934
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0529918108178033
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0507709453930326
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0696579609147833
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.009881297663264989
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.119091592748023
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.398296539843221
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[Fe].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.07578788359455581
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.394896466660449
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[Fe+2].[K+].[K+].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0903276836431198
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.140786736549013
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.135475398975478
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[K+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0435998536352889
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.032970915716778
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[OH-],CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0747024695482382
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0354390034048101
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.106667507465437
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.627748205525383
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Fe].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0883069339666964
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.791448787933051
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Fe+2].[K+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.100736710415608
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0445873996881102
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.158812147205277
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.230725794554218
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Li+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0706662929503855
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0412097046908743
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0670759985076743
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.026669019699592397
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0626688976583805
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.715426743156485
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Fe].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.100123867012383
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.614736557075014
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Fe+2].[Li+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0953958263011332
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.158867821005092
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.1790385630688
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.046130043777343206
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0459642896981618
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,CCN(CC)CC,CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0756429582547112
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0255668127054664
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0626426095027396
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.728355518057598
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.10166740209109401
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.674843767651673
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0964307010994259
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.150524628547964
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.190765245632751
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.048825316301071
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.054275666476842996
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,,CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0706177507228769
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0121874963064015
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.08887603949480241
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.491231313338811
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.111450714863157
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.435209625584725
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.08859086167460789
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.151234882786008
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.333686246020695
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Na+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.153450097553135
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.3095888171549
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[OH-].[Na+],CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.327228107743226
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.342365736501709
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.149072004805931
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.432999917758306
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Fe].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.17568163921407098
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.376451431377011
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Fe+2].[Na+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.145861369323008
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.130965528838726
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.15328775133598702
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.27298873243440697
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Na+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.37472464679775697
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.130775640329684
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Na+].OC([O-])=O,CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.278870043258673
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.144047483719651
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.25151362606933
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.165132712003237
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Fe].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.27559554505344197
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.309778179622142
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Fe+2].[Na+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.201635057853027
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.25898437255719303
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.126453446261064
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.28447930778054603
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Cs+].[F-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.136437201709157
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.318161138612688
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[F-].[Cs+],CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.309443734111355
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.319778129957951
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.281257991939562
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.18416637401632
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Cs+].[F-].[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.154551816393562
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.350038934121785
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Cs+].[F-].[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.20705101946402502
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.32237073536626804
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.33681629409575004
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.268502682369668
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.154977983662797
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.12565792957616298
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.143965448980969
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.130393494127328
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.152281211654499
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.222538143040283
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[Fe].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.172841815723781
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.22239746711181801
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[Fe+2].[K+].[K+].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.158290195173318
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.14974380115848698
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.137673419168311
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.149066264798925
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[K+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.183726199510341
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.225196257527756
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[OH-],CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.393059281212376
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.182419588944286
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.307733784438108
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.190166173545135
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Fe].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.16031791116049898
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.40249292419005
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Fe+2].[K+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.17678836448788499
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.156421247051227
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.262732573639549
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.128483834861798
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Li+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.229308714939199
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.12786387294468202
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Li+].[O-]C(C)(C)C,CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.133134959058639
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.116387643881743
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.13562445184587
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.168303425941005
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Fe].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.215478088287407
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.273315804937304
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Fe+2].[Li+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.26966017215133603
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.255475487427508
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.154193357422559
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.12621126052575302
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.174322145602985
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.133461992881114
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,CCN(CC)CC,CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.278880804699825
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.146491021576651
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.31023366249855
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.180202351501091
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.16245242834377
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.328601183833549
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.37853177894750095
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.15181192321977702
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.15364632886968502
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.138795032738065
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.146994500838519
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.322546483838239
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,,CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.176510887581189
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.169869857765644
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,,CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.41591873186716805
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.21472913175312702
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.182506178025478
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.37871278583067897
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.30355572946107
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.35315886081290204
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.139066953068002
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[OH-].[Na+],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7930587350894569
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[OH-].[Na+],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Na+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.854323885219076
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[OH-].[Na+],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8682375364200141
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[OH-].[Na+],CC#N.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.759827678379371
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[OH-].[Na+],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.417981680436534
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[OH-].[Na+],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.963777560137793
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[OH-].[Na+],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.926348539875478
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[OH-].[Na+],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Fe].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.467942717832163
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[OH-].[Na+],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.902063870232358
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[OH-].[Na+],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Fe+2].[Na+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.260223686397464
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[OH-].[Na+],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.107375169949463
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[OH-].[Na+],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.43154212745549303
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Na+].OC([O-])=O,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9329643396545331
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Na+].OC([O-])=O,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.[Na+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.908868932305634
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Na+].OC([O-])=O,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.934429714882574
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Na+].OC([O-])=O,CC#N.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.861336620157903
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Na+].OC([O-])=O,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.2821750835074
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Na+].OC([O-])=O,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9394010978454639
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Na+].OC([O-])=O,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7110856396898351
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Na+].OC([O-])=O,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.[Fe].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.33608740035921797
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Na+].OC([O-])=O,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.569614281729532
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Na+].OC([O-])=O,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.[Fe+2].[Na+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5953770347891161
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Na+].OC([O-])=O,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0063730496773270195
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[Na+].OC([O-])=O,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.231702052678754
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[F-].[Cs+],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7651443110080599
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[F-].[Cs+],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Cs+].[F-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.68499153125392
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[F-].[Cs+],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.835978581948845
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[F-].[Cs+],CC#N.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.709954176663073
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[F-].[Cs+],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.399838434308955
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[F-].[Cs+],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8402070595423371
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[F-].[Cs+],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.46805221490606397
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[F-].[Cs+],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Cs+].[F-].[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.37357520849976195
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[F-].[Cs+],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.46081145490547004
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[F-].[Cs+],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Cs+].[F-].[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.474619966140896
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[F-].[Cs+],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.012120096823103601
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[F-].[Cs+],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.19090403327122998
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.671406210140979
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.625643020715499
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.777103431674678
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.481714185233041
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.304007597011851
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8268733816794971
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.360816610133423
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].[Fe].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.364170291581118
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.340325267208681
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].[Fe+2].[K+].[K+].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.467290772717741
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0104773556690246
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.10133207767042199
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[OH-],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7874639498653541
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[OH-],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[K+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.767222979653099
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[OH-],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.874742953227683
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[OH-],CC#N.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6320272748042151
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[OH-],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.400559059542472
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[OH-],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.95568229157529
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[OH-],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7171205136278109
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[OH-],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Fe].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.399796885856858
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[OH-],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7415141560574691
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[OH-],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Fe+2].[K+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.492451569795546
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[OH-],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0938703929805834
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[K+].[OH-],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.209446895988713
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9098810000897259
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Li+].[O-]C(C)(C)C,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Li+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.967609424689599
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.919298669617397
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Li+].[O-]C(C)(C)C,CC#N.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.874932311504694
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Li+].[O-]C(C)(C)C,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.347271754713206
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Li+].[O-]C(C)(C)C,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9587597459659319
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Li+].[O-]C(C)(C)C,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.925255059883806
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Li+].[O-]C(C)(C)C,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Fe].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.489937734631707
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Li+].[O-]C(C)(C)C,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7553780378673529
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Li+].[O-]C(C)(C)C,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Fe+2].[Li+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.316507527894339
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Li+].[O-]C(C)(C)C,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0999382486028393
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[Li+].[O-]C(C)(C)C,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.279360056540966
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,CCN(CC)CC,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.91952898933144
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,CCN(CC)CC,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.888995505132022
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,CCN(CC)CC,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9131533200963111
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,CCN(CC)CC,CC#N.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.906035200560835
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,CCN(CC)CC,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.257204000110791
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,CCN(CC)CC,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.960522956516848
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,CCN(CC)CC,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8115653782981229
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],CCN(CC)CC,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.388778316787673
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,CCN(CC)CC,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.64301145622985
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],CCN(CC)CC,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.574149395882363
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,CCN(CC)CC,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.054938176425329395
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,CCN(CC)CC,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.168188211369926
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9108722281338799
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8334356810934339
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9034474219270809
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,,CC#N.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.677254172018757
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.21433123768133
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.918076837260175
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.616028054419406
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.476692785469898
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.426910274728034
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.621278487707647
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.00458217175311709
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.145607995062144
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[OH-].[Na+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.878245536400365
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[OH-].[Na+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Na+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9021367746976919
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[OH-].[Na+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8625374509761591
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[OH-].[Na+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7825815085087029
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[OH-].[Na+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7018112208550571
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[OH-].[Na+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.965742563881931
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[OH-].[Na+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7244407340932529
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[OH-].[Na+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Fe].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.678914276877671
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[OH-].[Na+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.716397837522583
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[OH-].[Na+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Fe+2].[Na+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.2499949167947
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[OH-].[Na+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.119653152002239
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[OH-].[Na+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0809832261440754
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Na+].OC([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.939902832501499
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Na+].OC([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.[Na+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.959307105913055
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Na+].OC([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9168854297456189
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Na+].OC([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.741853900605132
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Na+].OC([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5619837581806479
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Na+].OC([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.968863406821135
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Na+].OC([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6720104299093179
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Na+].OC([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.[Fe].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5538330579788631
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Na+].OC([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.48368473293901504
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Na+].OC([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.[Fe+2].[Na+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.171275562376447
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Na+].OC([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0465600176222329
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[Na+].OC([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.059029434788114704
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[F-].[Cs+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7282299592173029
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[F-].[Cs+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Cs+].[F-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.750848473232507
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[F-].[Cs+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.747880048332898
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[F-].[Cs+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.555129970068263
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[F-].[Cs+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.517094621897423
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[F-].[Cs+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.756178577194961
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[F-].[Cs+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.325581006087268
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[F-].[Cs+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Cs+].[F-].[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.44377692349185
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[F-].[Cs+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.193260381662172
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[F-].[Cs+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Cs+].[F-].[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.23531410727760702
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[F-].[Cs+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0645032151958811
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[F-].[Cs+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0681172692824835
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.601984165966287
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.707778455537634
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7015770909374279
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.346100805617181
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.345428487761742
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.796570581407781
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.34879591683823
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].[Fe].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.44650777602804603
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.24479843427874598
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].[Fe+2].[K+].[K+].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.192382473012842
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0140580220488972
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0680509238951124
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[OH-],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6668117832641759
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[OH-],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[K+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7379770635306361
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[OH-],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7562837369059701
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[OH-],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.440980301035265
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[OH-],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.524534202188087
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[OH-],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.878847493040702
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[OH-],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.511474832866481
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[OH-],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Fe].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.573629519109205
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[OH-],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5011640603795761
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[OH-],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Fe+2].[K+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.222208420041598
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[OH-],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.053141049830774
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[K+].[OH-],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.11926366521321301
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.927695400124084
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Li+].[O-]C(C)(C)C,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Li+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.877846242598397
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.892205501146468
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Li+].[O-]C(C)(C)C,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7360360445690981
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Li+].[O-]C(C)(C)C,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.733338474319106
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Li+].[O-]C(C)(C)C,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.972927783508637
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Li+].[O-]C(C)(C)C,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.68315418658157
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Li+].[O-]C(C)(C)C,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Fe].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.673962945873497
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Li+].[O-]C(C)(C)C,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.45584489242016196
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Li+].[O-]C(C)(C)C,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Fe+2].[Li+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.240433571694587
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Li+].[O-]C(C)(C)C,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.09879313318284909
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[Li+].[O-]C(C)(C)C,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0745828675729199
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,CCN(CC)CC,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9467060883570391
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,CCN(CC)CC,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9488441829384141
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,CCN(CC)CC,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.918801535351221
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,CCN(CC)CC,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8043018473934169
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,CCN(CC)CC,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.412847585417364
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,CCN(CC)CC,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.978329449296663
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,CCN(CC)CC,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7045397941790441
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],CCN(CC)CC,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6866498733646069
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,CCN(CC)CC,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.609473840012232
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],CCN(CC)CC,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.215709525743314
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,CCN(CC)CC,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.09138064900583281
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,CCN(CC)CC,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.105255738483675
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.92980256996138
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.954822007995574
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.922207396406297
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8146502915585759
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.651398748588359
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.978636516109226
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.613868800661312
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6397988192685959
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.630416834902842
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.204537082140744
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0835701625669272
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.143384568520245
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[OH-].[Na+],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.725681439468749
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[OH-].[Na+],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Na+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7593823728919431
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[OH-].[Na+],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6636808292913069
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[OH-].[Na+],CN(C)C=O.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.555596087584328
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[OH-].[Na+],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.170987293894825
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[OH-].[Na+],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8108903891577209
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[OH-].[Na+],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.59547952691366
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[OH-].[Na+],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Fe].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.376611857663036
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[OH-].[Na+],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.264382139838733
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[OH-].[Na+],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Fe+2].[Na+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.13839477147164
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[OH-].[Na+],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.09740420839104379
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[OH-].[Na+],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.104238372442602
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Na+].OC([O-])=O,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.131975023241021
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Na+].OC([O-])=O,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.[Na+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8439361389405959
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Na+].OC([O-])=O,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.299760743566376
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Na+].OC([O-])=O,CN(C)C=O.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.37336348913191303
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Na+].OC([O-])=O,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.1155581858807
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Na+].OC([O-])=O,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.507894203045131
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Na+].OC([O-])=O,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.272758750869207
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Na+].OC([O-])=O,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.[Fe].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.14780282042776802
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Na+].OC([O-])=O,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.108792165969558
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Na+].OC([O-])=O,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.[Fe+2].[Na+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.174514865277172
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Na+].OC([O-])=O,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.014808086817363099
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[Na+].OC([O-])=O,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0786774284701017
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[F-].[Cs+],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0948398984280171
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[F-].[Cs+],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Cs+].[F-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.846113522629119
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[F-].[Cs+],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.579442477840885
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[F-].[Cs+],CN(C)C=O.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.575607390442796
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[F-].[Cs+],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.145094890033714
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[F-].[Cs+],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.803624975734139
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[F-].[Cs+],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.622567151765963
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[F-].[Cs+],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Cs+].[F-].[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.287090078193735
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[F-].[Cs+],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.448113249722399
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[F-].[Cs+],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Cs+].[F-].[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.143777820569795
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[F-].[Cs+],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0187759395380552
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[F-].[Cs+],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.15998077002494301
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5079309705346661
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.729421829125822
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.566516915891652
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.299625890070721
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.161955295563684
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6570880225709049
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.222386181001037
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].[Fe].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.23105522173493198
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.293491578440422
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].[Fe+2].[K+].[K+].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.12762640122708102
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0137662012200758
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.07449273182643411
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[OH-],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.491500974013581
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[OH-],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[K+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.801808959600576
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[OH-],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.672247896803707
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[OH-],CN(C)C=O.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6071444564792831
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[OH-],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.20574185429275602
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[OH-],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.849881268158938
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[OH-],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.626649492990998
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[OH-],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Fe].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.403218965509842
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[OH-],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.305543683112688
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[OH-],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Fe+2].[K+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.157445634310627
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[OH-],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.14104415596125
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[K+].[OH-],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.215208583335199
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8207458957875611
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Li+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.812281961321919
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.590223325743143
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.641297453220397
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.16870474871704602
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7737750506075101
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.485045497988158
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Li+].[O-]C(C)(C)C,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Fe].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.39143080387714
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.18950140999335102
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Li+].[O-]C(C)(C)C,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Fe+2].[Li+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.140695732314952
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0385447870248434
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0838810446521811
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,CCN(CC)CC,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.669668696437728
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,CCN(CC)CC,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.695766895379131
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,CCN(CC)CC,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.500621215487161
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,CCN(CC)CC,CN(C)C=O.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.38245277547681505
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,CCN(CC)CC,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.232348796643026
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,CCN(CC)CC,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.650272107611885
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,CCN(CC)CC,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.22762489116286802
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],CCN(CC)CC,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.195661151843113
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,CCN(CC)CC,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.22267518245382298
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],CCN(CC)CC,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.12810493106635198
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,CCN(CC)CC,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.00928452792167654
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,CCN(CC)CC,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0821072307916277
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.684985292339853
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.728530605514499
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.575416056423877
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,,CN(C)C=O.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.28695308959908
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.179095920727159
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6232477800109141
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.207688599140117
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.205855716235825
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.150951798029309
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.171519852139986
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.010100103434568498
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0891484336587966
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[OH-].[Na+],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8504832657513739
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[OH-].[Na+],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Na+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.928013860243797
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[OH-].[Na+],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.773378235730568
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[OH-].[Na+],CO.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9124001767272929
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[OH-].[Na+],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.869986862489349
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[OH-].[Na+],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9157679255269371
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[OH-].[Na+],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.928840274278229
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[OH-].[Na+],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Fe].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.545191484610738
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[OH-].[Na+],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9127332245860219
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[OH-].[Na+],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Fe+2].[Na+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.551599121311216
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[OH-].[Na+],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.008035067602278791
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[OH-].[Na+],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.714860589273228
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Na+].OC([O-])=O,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.778848124982425
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Na+].OC([O-])=O,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.[Na+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.926045511468057
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Na+].OC([O-])=O,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8173439942744071
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Na+].OC([O-])=O,CO.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9224322686394829
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Na+].OC([O-])=O,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.93790441521871
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Na+].OC([O-])=O,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.869794015893373
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Na+].OC([O-])=O,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8569026526395269
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Na+].OC([O-])=O,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.[Fe].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.312726420533381
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Na+].OC([O-])=O,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.821929700063523
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Na+].OC([O-])=O,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.[Fe+2].[Na+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.273703223526524
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Na+].OC([O-])=O,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0217615695536244
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[Na+].OC([O-])=O,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.511038546033731
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[F-].[Cs+],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.695588793934555
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[F-].[Cs+],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Cs+].[F-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7545569333650021
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[F-].[Cs+],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.755841945577877
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[F-].[Cs+],CO.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.754250494436815
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[F-].[Cs+],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.874063595646459
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[F-].[Cs+],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.804993374094072
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[F-].[Cs+],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.566404005273951
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[F-].[Cs+],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Cs+].[F-].[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.37654509960654897
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[F-].[Cs+],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.456400175571482
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[F-].[Cs+],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Cs+].[F-].[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.16395127598179102
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[F-].[Cs+],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0160133740786695
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[F-].[Cs+],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.319265419430075
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.846207648737311
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9466760633649589
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7631014062364789
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8884410561721281
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.903122427258495
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.894195705834737
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.925420444110879
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].[Fe].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.463999368904516
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.90686354031853
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].[Fe+2].[K+].[K+].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.216094387834433
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0303077028963596
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6653356410008119
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[OH-],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.813252940387323
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[OH-],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[K+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9260849807612109
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[OH-],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7161894346522379
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[OH-],CO.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.897435135864189
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[OH-],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.882403317307475
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[OH-],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.854580015949466
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[OH-],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9114390992499279
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[OH-],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Fe].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5468392277136931
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[OH-],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.905472946483825
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[OH-],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Fe+2].[K+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.34003237093973804
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[OH-],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0102296018856456
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[K+].[OH-],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.688942947434202
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.824407782264567
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Li+].[O-]C(C)(C)C,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Li+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.92897086028179
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.696042882926731
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Li+].[O-]C(C)(C)C,CO.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.893372501650704
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Li+].[O-]C(C)(C)C,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8809193009173061
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Li+].[O-]C(C)(C)C,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.855838032171892
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Li+].[O-]C(C)(C)C,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.922723911352374
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Li+].[O-]C(C)(C)C,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Fe].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.486042918754773
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Li+].[O-]C(C)(C)C,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.906165000399185
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Li+].[O-]C(C)(C)C,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Fe+2].[Li+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.21407979727544402
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Li+].[O-]C(C)(C)C,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0122184090817358
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[Li+].[O-]C(C)(C)C,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7134333778256131
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,CCN(CC)CC,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7415443702005621
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,CCN(CC)CC,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.829883888481488
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,CCN(CC)CC,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.73005947963626
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,CCN(CC)CC,CO.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.759927239896771
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,CCN(CC)CC,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8527669180151151
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,CCN(CC)CC,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.828384743612249
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,CCN(CC)CC,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.587873369140485
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],CCN(CC)CC,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.37123353950241106
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,CCN(CC)CC,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.523663941685067
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],CCN(CC)CC,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.211139704927221
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,CCN(CC)CC,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.00502307775377253
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,CCN(CC)CC,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.292574785463871
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.53804358256689
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.627803795146716
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.615727585372283
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,,CO.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5254395652725851
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.637819400768771
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.623651842739079
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.36201632298176795
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.26264529125812297
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.266943881989596
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.15942398141039
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0118343325595829
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.20824281400196298
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.563815376680642
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9660332443172329
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.837851628591261
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[OH-].[Na+],CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8756986549579879
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6999341541819191
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.914651756598927
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.914671013624199
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.849527381024769
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.926924265819583
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].[Na+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.523962683095524
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.227751187971528
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6391154091857021
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.668574734170733
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.985294270039544
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.942640845367367
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Na+].OC([O-])=O,CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9304725921219961
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.784358729204544
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.927683860927582
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.78306905317854
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.40677429137295595
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7807715997833979
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].[Na+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.796108269330847
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0069913436702769005
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.531092423344983
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6612731423038051
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9648593246915711
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.936890469217555
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[F-].[Cs+],CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7645551389051041
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.613870175474844
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.883121472963714
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.454580856020021
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-].[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.349337289324742
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.664591789670594
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-].[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7226559232972779
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.029609017960367797
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.355723204921242
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7025076771574941
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.876806814105779
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.879108904068517
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.410773449584371
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.44256592020046803
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.824072207924869
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.44114316446220597
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.34264771112272
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.470845518291229
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].[K+].[K+].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7841897059422941
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.043225527915597806
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.36590434153333
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.680572566589148
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.96489796574186
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.902318088677183
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[OH-],CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8183732210004101
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.642896330104911
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.929608440086605
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.807287818434782
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.623644080548464
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.846748239353971
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].[K+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.869195801897391
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.109215691582193
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.551875022371497
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6843077280849831
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.974247377479216
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.847396825858562
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Li+].[O-]C(C)(C)C,CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.920925007637893
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.827709335345633
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.911687837777769
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.908939561818585
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8541055463980339
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9109973145365341
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].[Li+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.273944628344096
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.160373806385924
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.367026825496247
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6759359985821951
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9745491414053871
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.850384910294823
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,CCN(CC)CC,CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.926953164510429
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.704521026988636
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.925187532871576
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.913685791204355
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.41668135399844
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.805863442755513
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.81210639342736
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.09062159433887419
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.616132790973319
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.747407477880316
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9746162787836229
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9067429897136221
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,,CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.840502275333941
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.584379303982543
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.88704418844604
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.713468860497993
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.359547249921109
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.667695535917472
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7665000459271439
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.07364547589880739
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.394718743525235
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5121976910034021
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.963242391228999
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.33566714168107
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[OH-].[Na+],C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8935392013684149
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.606843891405642
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.29570330814129003
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.938583499330187
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.513820782848313
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9580146182604029
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].[Na+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.274717090885366
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.47214125824331704
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6414770312802319
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.548505815180369
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.872486387938509
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.257214813415071
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Na+].OC([O-])=O,C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.926982495813368
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.437483084080667
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.306044457630202
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.866954853801412
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.441228855777834
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.876529306878723
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].[Na+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.652477154725794
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0825821294321349
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.228739644621073
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.223722230897266
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.678762954701526
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.15150091463067
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[F-].[Cs+],C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8383806548522721
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.118312935386201
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.29452670500197997
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.529065760960835
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-].[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.40847072401837403
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.556587667829784
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-].[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5232019958873549
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0436798550716311
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.144321771976119
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.276307724280606
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.656644245180106
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.149881622405924
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7306847671202409
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0933043179541265
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.237805766149116
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5477743619396009
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.426590673293004
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.479034110346946
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].[K+].[K+].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.431539636009296
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0576242081536026
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.18755033184098502
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.332611153922379
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.845103391623804
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.11464075044506
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[OH-],C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.656365072356089
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.269869378125437
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.24542227341082298
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.613484918120441
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.470368624273923
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8082850295715259
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].[K+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.278327925718935
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.17763017290531302
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.299519317390657
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.537756378178781
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.858779367670267
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.23630842523858198
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.657421098292381
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.48326149461731605
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.267105163103183
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.936678684812441
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.496304477267633
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.954958948847799
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].[Li+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.241005232974831
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.428940158162194
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.629966030221791
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.490170408129729
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.860696699684853
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.280777869794065
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,CCN(CC)CC,C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.75261012861474
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.540637459059965
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.266110715140147
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.938081162096646
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.4974444552099
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9584525996269009
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.270272772906929
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.378788146058671
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.560634797667103
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5677729729190399
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.82299024541829
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.42797180466122
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,,C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7564247175109451
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.559591173174982
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.256642445847855
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.952137226541972
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.461256886470727
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9519031199854401
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.284752672789179
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.320983522115381
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.543610791860469
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.402016779071846
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.66316553568736
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.431762239449345
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[OH-].[Na+],CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.570848317866516
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.33917619132634896
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.543002285368659
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.552657618023296
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.418738778286835
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.472239119947404
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].[Na+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.400320325336921
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.26733989167063
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.255504262192032
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0929353091704395
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.922769390802099
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.543634752974235
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Na+].OC([O-])=O,CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8854659792130251
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.275512880242055
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.431959070349507
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6469092919475421
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.26736582859779
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.528515237001515
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].[Na+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.802761512511913
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.00576354581847615
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.25691197237042
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.08712156078487769
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.911445698800749
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.764355701961598
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[F-].[Cs+],CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.944626212201736
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.600045218174972
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.948036555322924
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.778951815355133
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-].[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.548864102297303
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8798628749863631
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-].[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.973170157569852
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0668843758003913
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.468416411184166
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.196209213859596
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.89868453870243
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.699271913427484
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.556445065342882
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.46828463507533497
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.694849051478207
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.464440818732198
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.351183819899968
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.434972344170685
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].[K+].[K+].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.654814855584207
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0708940603391516
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.20917749974372002
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.27962205582801203
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.839539768451087
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.566497527312536
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[OH-],CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7421729624883789
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.401087287963718
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6454387189822179
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.671643904286913
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.486092693827022
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6439250914538001
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].[K+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.624816607995947
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.244153806316805
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.260734007213043
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.525757458703708
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.829642939198487
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5607328117278
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.753635845832302
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.373506814878029
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.609434238483504
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.687015095605056
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.519343215040013
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6692896256819251
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].[Li+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.257225058779189
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.201212940993627
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.248452650814288
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.207434378656279
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.601765986747185
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.358824473094312
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,CCN(CC)CC,CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.34247122938991
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.270998772262528
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.430192330840722
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.233258000694708
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.302554172667768
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.279060864761281
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.306828657268812
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.21286344137102803
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.249719287531734
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.20900093620436
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.571911827769484
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.410239934866346
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,,CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.337838254817375
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.316665626730205
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.484813742902846
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.264701529672198
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.29294813876735903
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.26281606098641797
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.37572139017486994
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.210286801294353
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.245716861758776
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.450304228777805
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.96700831389957
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.707580503474366
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[OH-].[Na+],CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9332653800015299
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.632786528917237
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.611317292976072
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.94817516544428
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.47133210118384705
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.889674829238713
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].[Na+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8748004795469041
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.33879875959112
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.77509842501393
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.407327328326207
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8858770214579179
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5842970799873161
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Na+].OC([O-])=O,CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8913175178965941
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5571631456292621
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.645182134995584
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.817288209420188
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.400443007422297
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.75348387241279
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].[Na+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.644970307953099
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.226652814403909
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5622875089106479
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.43132174190208
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8572601019332989
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.777197626673195
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[F-].[Cs+],CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.898101985060876
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.489138381009802
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8651267932323939
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7187534924550739
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-].[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.467022227025361
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.605121130014356
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-].[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.37672412948063605
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0804031681925384
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.472354483452669
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.321468820196592
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.941499649419957
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.618438709765428
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8383216605687539
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.589444246196872
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.596691306469937
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.901013537444111
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.691646106227169
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.83350419880264
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].[K+].[K+].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.946759971229246
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.141987917137883
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7497340768083841
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.330192631689675
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.939385774065647
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.619580940195727
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[OH-],CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.821049549613392
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.551292974217532
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.629561815228122
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8813480000971841
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.676398571648146
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8232138803876969
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].[K+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.916452876915113
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.264091474925865
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.676446362480466
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.333655093584347
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9530631312742899
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.584174409156164
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Li+].[O-]C(C)(C)C,CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8067518689020701
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.48821570126373504
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.570546652155454
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9089871387317071
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.737243358898002
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.828807292408567
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].[Li+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.938212282452386
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.35829860176184397
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.640966274353448
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.402192449568601
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.887417591161115
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.729780451596398
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,CCN(CC)CC,CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8805310873097111
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.56978594771859
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8085406655811159
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.768882255240068
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.645578151590352
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.68570425753669
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.910623978489854
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.09944314355094021
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.453749842677043
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.303429889351404
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.753648143731827
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.533804357121031
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,,CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.751348432487518
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.37055297108630597
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,,CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5877612058950821
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.402126731528118
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5029039580802079
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.294236695683706
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.229046049849926
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0499588280540645
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.268815426316681
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.933082818823666
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Na+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.936990334539363
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9432691349402771
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[OH-].[Na+],CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.87351296880299
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8408660823770769
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.956509037806468
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8760386155929121
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Fe].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.897228353947852
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8660454349766751
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Fe+2].[Na+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.471364813572141
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.348043384048705
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.765155368256539
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9146721743609789
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Na+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9327071104035
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9403295813596501
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Na+].OC([O-])=O,CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8403586230822
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.869236749146928
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.920089236481985
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8748858517596471
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Fe].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8718351161082449
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.849418316480437
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Fe+2].[Na+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.961995249325649
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.37027957649593196
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7622379905564639
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.876071010218673
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Cs+].[F-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9585364279879509
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9030201912199181
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[F-].[Cs+],CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.889916881963926
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.805498334225993
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.91074319336334
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.839804750691562
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Cs+].[F-].[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.829780870716018
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.799341010821554
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Cs+].[F-].[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.891916912410665
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.620338796876499
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7029101013986739
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8354486460211319
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.911760889441438
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8692201273691179
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8130614569814629
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.73718500511608
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.857456037486109
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.717751005605803
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[Fe].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.756856446559635
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.656898753516825
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[Fe+2].[K+].[K+].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.794505063010448
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.43211259683526004
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.500622552282643
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.822894396767116
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[K+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9135376450589099
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.897383680766021
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[OH-],CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.839061270241134
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.812492124439384
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.93119800141071
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.866361652507039
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Fe].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.892666484008556
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.859545161109764
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Fe+2].[K+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9213394450392499
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.690874901334299
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.812877921735839
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.929176319064448
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Li+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.982020524115041
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9095759773340061
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Li+].[O-]C(C)(C)C,CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.91734671431913
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.900348907764315
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9464377864672819
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.934276246279765
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Fe].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.902305576407354
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.883688647063783
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Fe+2].[Li+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.909175990829164
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.562000486259436
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8337441241700251
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9188782089793309
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9481829770539341
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.912374224066853
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,CCN(CC)CC,CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.914014526903169
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.858548938473938
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.920271360881684
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.852084319106705
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8530486591580041
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.790929497934725
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.872958218345057
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.565115822709545
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.627984477470581
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8042768397503111
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8165679569658301
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8070689000135719
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,,CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7134580429114391
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6883898360417849
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.807707819426298
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6775826031536301
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.70969492066811
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.63553935331868
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.779308151541255
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.45408785491322595
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.48736765379012903
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.885035713430579
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Na+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.959532385279647
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9407783156836059
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[OH-].[Na+],C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.886029509376872
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8330326894105311
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.961446416304454
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.868849327266406
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Fe].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7625195769087421
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.839317779392095
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Fe+2].[Na+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.885732832728593
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6152783318293941
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.731023633956503
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8382054250264891
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Na+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9133847801715309
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.83053175545778
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Na+].OC([O-])=O,C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8173799133549661
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6498136717678039
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7442781850071369
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.604045841496635
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Fe].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.52812543551642
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.554718656879997
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Fe+2].[Na+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7150925878285319
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.37372888875971
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.45257582968313204
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5562353735169571
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Cs+].[F-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.704463021933756
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.637782452612753
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[F-].[Cs+],C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.628084348722476
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.48774840505949596
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.628960409330221
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.39396631457359904
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Cs+].[F-].[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.431326104554081
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.40117583416627495
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Cs+].[F-].[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.541338617404061
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.245111243309589
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.292073966212255
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.476209950650479
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.615094020434735
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.591413496620728
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.527950947515621
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.45493485580440596
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.632047946537133
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.39213918315142204
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[Fe].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.46248860905951505
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.381683660049286
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[Fe+2].[K+].[K+].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.569404141597475
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.27838959395838797
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.299899616604056
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.529501439791337
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[K+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.654545043323783
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6890067688418821
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[OH-],C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6573599360641209
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.48979469622910005
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.699341107699935
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.595446242882578
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Fe].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.64696266967661
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6061504948534749
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Fe+2].[K+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.717343918626155
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.48621870257282196
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5594276745554
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.731994081296784
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Li+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.817686620469832
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.771281633604583
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.775655651145343
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.677502442601315
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.847166455727105
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7349826941423381
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Fe].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6601448840950469
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.739491449890844
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Fe+2].[Li+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8127958057134861
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.552493495234842
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6616501947890641
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8190646311740499
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.876426565100184
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8489988164220741
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,CCN(CC)CC,C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.801338109965821
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.701437777255678
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.878719622749359
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7429443360366059
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6538184715015799
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6797237563128969
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7341642949060051
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5269644118536231
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.675724930571385
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.810783110720897
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.886709048868025
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.846701390055562
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,,C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8258484811388649
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.693233923401167
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.816046494819723
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.70566664550898
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.618424718029844
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.626153389510912
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.754866871068105
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.448804094332413
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.528361854277602
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6494726364309339
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Na+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9337528937571651
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.895120857149761
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[OH-].[Na+],CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9128903355599419
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.748669163156693
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9179274998311879
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.830248873940869
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Fe].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8772322761670119
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.756219070666031
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Fe+2].[Na+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8066429091619921
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.638998051889429
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.556786598466945
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.09620040094358799
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Na+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.894511954993892
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.812926448425775
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Na+].OC([O-])=O,CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.849750732307847
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.656893279851293
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.730818561691866
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.680702243069637
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Fe].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.607066463197139
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.724431404746132
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Fe+2].[Na+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8062679579353891
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.23326216999058602
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.612570924572004
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0880382606203384
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Cs+].[F-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.906075320076731
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.87351974159486
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[F-].[Cs+],CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.897799217035857
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.794698492803934
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.901839525147503
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.831047866530652
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Cs+].[F-].[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.76607498040446
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8547920320619259
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Cs+].[F-].[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.913231611771534
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.247472644417066
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.798280779313199
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.12072020654995401
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8826531310448
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.829233530958889
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8035432389818931
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.667182501897971
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8356044920584069
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.599095345029385
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[Fe].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.566706834377251
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.579831979353366
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[Fe+2].[K+].[K+].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.71548144439022
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.254594039714626
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.380402524706954
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.49994055358614903
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[K+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.927344040614844
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9014428901839859
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[OH-],CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9078636058528581
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.679192161486874
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.926997567854367
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.853651142162517
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Fe].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.818952806735479
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6605081589656401
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Fe+2].[K+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7098668182650689
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.658132431711666
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.476932440880613
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.762018479366771
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Li+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.964196020294068
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.945733750904256
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9279849284961721
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7368193924610409
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.945749207830065
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.860815396695893
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Fe].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.839601648066985
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.752941043352629
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Fe+2].[Li+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.34869117814154005
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.51765670320219
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5420152911610461
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8254107529168
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.872657695571432
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.800675568012807
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,CCN(CC)CC,CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.623403824889598
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.600318151557615
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7945582698715851
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.524314644176922
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.492794219097397
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.508471638858617
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.567770993547277
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.160319927649936
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.244878511486375
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.713194985869433
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8447170989534151
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7824231678717121
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,,CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6687200425737729
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.568617678630696
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.723770263118878
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.479026471416584
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.476685976251887
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.482538858959639
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.604233901960798
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.016115104245101698
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.27795833202073
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8610916871130221
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Na+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.936487172275639
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.920669339153271
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[OH-].[Na+],CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.93781765674746
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.918252223519439
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9414676207795929
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.902571937587943
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Fe].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.884328406478941
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.914527281466888
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Fe+2].[Na+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.915721069675891
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8259292576190851
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.900532939247157
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.717176779733418
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Na+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9381576018208391
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9251650386036501
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Na+].OC([O-])=O,CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.924342451564313
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.910793941748596
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.931337812573883
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.866268166767732
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Fe].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.75006723547921
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.863627571903601
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Fe+2].[Na+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8962856033496951
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.536163430073465
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.888005918484547
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.759145045329842
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Cs+].[F-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.892862717770382
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.857602869331088
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[F-].[Cs+],CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.880054742215321
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.886040493446914
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.903935587402495
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.65603575095592
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Cs+].[F-].[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6745045013808431
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7771720415121279
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Cs+].[F-].[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8298796325007111
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.323170389016353
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.750749609442436
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.912878952800186
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.967376643226456
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.928242218597128
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.962965551611922
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.937275077399634
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.953713771253362
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9137383362616499
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[Fe].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.881280570060825
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9079401634778079
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[Fe+2].[K+].[K+].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9229813130843909
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.67916947190213
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.912140138328445
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.920579578313443
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[K+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9447070233478579
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9208408392725249
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[OH-],CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.925177803257656
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9199361328454251
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.950559187355325
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9053133266039219
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Fe].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.881775757631044
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.905730870845968
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Fe+2].[K+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.922488403922945
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6580312156091059
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.907888162800506
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.940103735997673
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Li+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9869221771539389
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.932824954358793
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Li+].[O-]C(C)(C)C,CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.92968105197347
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.926467307723407
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.960383758115784
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.91753601201934
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Fe].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.903263933331388
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.914483127261543
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Fe+2].[Li+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.930482496471217
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7763243982710369
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.91817884928389
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.815817380719798
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.898002920661409
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8654394073398559
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,CCN(CC)CC,CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.880602480794513
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.877643022399226
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.890948351177002
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7250746379568259
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.724492752083549
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.737652474463156
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8449461882440281
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.574065432301584
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.783908611308876
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.595370722322467
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.46283121782445796
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7203440213434681
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,,CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.736485616659474
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.689568539102562
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,,CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.721760945936615
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.48824550431789704
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.560405667104939
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.48589176131649703
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.520585262632616
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.25769502775829
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.507498318365167
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.34302152287556603
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.780345702790737
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.625931351515949
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[OH-].[Na+],CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5024619444056669
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.505597785763222
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9561795761425781
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7484440682752771
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.335237002036175
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.679652029875628
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].[Na+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.435992429644484
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.145337918808092
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.16949913729786498
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.442399831020995
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8730632545845041
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.895447145100221
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Na+].OC([O-])=O,CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.602086569753873
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.52951945134082
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.806409016371755
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.604908003692653
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.354593831235752
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.502041758388827
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].[Na+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.616163920814564
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.076786360715506
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.279544842370796
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.425691960088876
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.830476407049367
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.88276759045408
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[F-].[Cs+],CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.732534614580344
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.694606104683676
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9860751708498781
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.689533763116145
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-].[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.49278610174424003
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6013794342288911
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-].[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.711636829120658
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.07391027546712879
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.257615027500093
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.429072489088978
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.74445840138102
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8423367652352719
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.425534837680731
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.58613227044268
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.705177521911792
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.612076244552951
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.466971920293133
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.559417180226987
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].[K+].[K+].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.158982033601282
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0963301475876354
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.36223676067953003
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.658566581439841
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.914627139853268
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9039543009019739
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[OH-],CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7177550992946421
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7166025375866439
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9614859740009901
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.84762071368733
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.491912790370873
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.794428104441856
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].[K+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.14559379909691
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.17036842232038102
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.25634819059642
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.729003288029776
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.958566280976642
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.938427090696509
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Li+].[O-]C(C)(C)C,CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.711167616095841
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.594659273679963
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.957750298246301
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.862817314535841
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.510400696784113
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.605377955317527
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].[Li+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.1112480288486
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.235426960015292
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.155165106552229
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7209291772533101
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9243454237566531
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.924890970281085
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,CCN(CC)CC,CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.58640945906875
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.497935499750216
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9535528558340761
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7076870001726719
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.47923861312925503
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.616098836618289
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.128766493290114
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.158640250029994
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.267970899225477
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8099289497297769
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.866255245271108
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.890208973919671
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,,CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.448155382456777
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.523945171380442
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.972495656938971
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6167738725187359
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.40607308841199
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.494815240453717
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.158835584007231
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.08521731525568599
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.264876725518377
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.314522898893397
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.92889533960699
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.23197285220262798
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[OH-].[Na+],C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.662454444128696
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.32294951891756496
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.26795339642649
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.909449375555629
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.655825588187851
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.899999615029945
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].[Na+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0638003592399953
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.541350738056367
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.400786505833032
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.35099778504519796
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9616227935454159
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.221938305525881
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Na+].OC([O-])=O,C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9528667888646849
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.167158994806734
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.30066263849003
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.763741942586495
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.580136687307058
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.809606671312747
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].[Na+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.14138821291907
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.167673024035108
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.293963782371383
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.174831506250365
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.858228318573989
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.191108904724288
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[F-].[Cs+],C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.949963250182257
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.226507182232499
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.37686632358256394
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.532291394750904
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-].[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.511293642445377
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.705068421279761
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-].[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.690917820500898
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.120576195929311
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.211102760439389
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.214424225089512
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.83612594167887
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.298566209569868
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.775912804233638
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.203524328828996
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.31693406043788597
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5507417826797181
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.549521596332503
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.657963337255518
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].[K+].[K+].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.12536499410996899
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.10974820488392499
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.292598147809964
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.37310085323578696
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.907496609075897
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.237712415718316
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[OH-],C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.750155939023614
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.339210947845839
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.23221465586286802
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.823075352644986
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.64353004166667
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.843449496355327
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].[K+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0925174730363101
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.43296354693423195
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.469105641321907
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.388824045021113
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.94449621217418
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.205132302231248
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7910434119588711
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.302905859938007
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.185495815258272
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.942656985182625
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.573866884073415
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9360689360944301
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].[Li+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.335312057497017
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.48905393847933804
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.465915446149973
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.377963795153632
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.960192350813869
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.150531754577844
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,CCN(CC)CC,C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7326688763904551
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.353231416019895
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.288593243155484
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.950609493152231
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.572514742086903
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9169768016736781
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0873547513596425
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.444177808130703
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.432714310577919
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.39911737267166103
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9614613330031869
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.259658318424576
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,,C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.943048446792551
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.254790723003758
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.26313145500227203
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8224135266250271
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.602014070631786
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8188097908944301
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.166049628933958
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.21458181937920698
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.341556744446873
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.528703389987893
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7141368813128879
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.43535580999175205
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[OH-].[Na+],CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.546781378903793
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.292018796736577
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.232854035152769
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7063211034810649
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.40864816974273305
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.689225985088905
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].[Na+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.04683756334319009
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.249744723580533
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.284812368020202
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.22797913455577798
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.909901316585558
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.461716126737958
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Na+].OC([O-])=O,CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6025101124233561
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.314535470200849
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6831245570739359
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6634503150499209
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.38507002764548404
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.526271709938845
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].[Na+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.131162954921524
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.16143581323278
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.270390557065737
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.103282009692704
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.920432386364945
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.665562436230106
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[F-].[Cs+],CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.931015628202002
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.587930091183782
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.912628421258705
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.728203662105258
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-].[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.545215659776639
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.670233470050889
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-].[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.770066732224419
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.130325873676274
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.47804145458216196
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.23792097135499402
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.833602527071705
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.660885062196838
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.528829767612839
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.439629277789052
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.650952304380114
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.475954418256477
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.507454913248354
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.480170639000037
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].[K+].[K+].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0948658416159843
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.12693076452366
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.30263147357056
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.397933943065932
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.838747797373195
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.61519189246293
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[OH-],CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8901006074875419
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.547785853863385
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.52040426733477
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7479624746291781
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.552907699935107
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.713611552730965
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].[K+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.10722385091264601
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.44003721941268803
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.453211553724902
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.618831367290825
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.890406974714526
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.672404425194176
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.712086646934789
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5762004561315099
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.536672126470195
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.770618356353546
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.574510604032353
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7499694214322981
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].[Li+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0494387827210926
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.452639557385591
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.304370219792946
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6531629365117649
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8590272422541829
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.577839535147763
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,CCN(CC)CC,CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7055072493936091
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.45405656027018404
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.537769027688631
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7532619792603841
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.603323951344361
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.655683038126891
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.07655613165955699
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.428386958233556
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.387902792904652
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.600520602257696
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7965592226788969
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.45655826672416194
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,,CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.680274531014674
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.521344929593985
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.498188603527536
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7112060978535121
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.482065927164787
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.740788205454093
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.10393481618732099
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.41872192422396
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.277555246917895
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.28737720360611
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9099657799465869
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.46009117259312704
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[OH-].[Na+],CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.623415638329921
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.541211014769654
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.36298595878381495
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.726265853885394
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.39802949831490897
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.636098491089908
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].[Na+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.559954957684824
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.13506741215635398
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.567099807154069
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.26251519340239
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.925414293181436
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.547532502589442
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Na+].OC([O-])=O,CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8921677211524419
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5528361166385021
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.46339881331161203
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.573805946113847
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.34963030867406
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.560304790291231
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].[Na+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.600656048406233
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0814493179134905
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.480428262451302
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.305438700170705
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.807684981175122
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.381509670196038
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[F-].[Cs+],CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.795580286946691
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.488196197220795
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.41535300606281295
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.313556222311822
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-].[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.414067136185596
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.360825607102773
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-].[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.363395992354291
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.038173575445812596
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.252377015988282
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.254721833120706
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.947374867685552
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.55379515367567
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8307229938265699
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.612357911071971
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.404037784002745
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.742866106906315
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.435645620592601
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6852321650330679
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].[K+].[K+].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7278009888425739
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0785982615196756
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.568274795573803
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.19328309383910303
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.942023130760561
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.510969624505909
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[OH-],CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8286910301681981
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.582135210324476
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.35001833507256497
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.735144781527612
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5039253058316561
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7160044743147731
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].[K+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.738427400196465
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0877430872991212
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6030181525593961
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.22382958426002802
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.947395154972839
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.501500654546992
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Li+].[O-]C(C)(C)C,CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.867848694235697
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.580748228983472
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.36270461480124294
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.764886339893108
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.518673922580198
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.763815582154522
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].[Li+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.606261395282826
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0971585349581309
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.650863610187377
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.223016853415226
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.863474248411526
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.39956425924601596
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,CCN(CC)CC,CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.749876095218663
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.48585054292393504
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.42816124263151
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.389260899233888
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.312694417666723
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.403195272391227
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.460645713469855
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.046299460658467705
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.304428813532659
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.24845494372531501
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.676717404378413
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.313330177594192
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,,CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.605673380318994
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.397556918466916
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,,CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.34182098793806603
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.29215048626243
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.312425283803562
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.288667107841666
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.306110395010146
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.051664912408424205
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.249627268481002
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.934500474296557
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Na+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.917709557266964
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9483023623592569
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[OH-].[Na+],CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.856593135940838
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.848863469499335
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.943892609041672
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.919647568082568
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Fe].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.915930623081787
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9064146442219
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Fe+2].[Na+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.486052315231434
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.38451580316879796
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.767942898061624
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.902111313515345
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Na+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.863098309205961
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.944100235155341
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Na+].OC([O-])=O,CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.834398164780506
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.78903401132295
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.871176005027116
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.739404068093
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Fe].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.731546503477806
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.749914681926067
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Fe+2].[Na+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.768844420088051
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.276563080810322
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.509828020981991
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.772902434645098
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Cs+].[F-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8290282177651279
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.911772977676256
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[F-].[Cs+],CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.739796704654368
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.771499986550364
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8857894880907431
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7620088058616029
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Cs+].[F-].[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.717538045941638
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7225094745452629
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Cs+].[F-].[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7292100122498291
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.29544920907460404
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.442147148290608
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.735134299691255
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.765770470450674
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8513878216920711
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.656077062655911
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.663779665734137
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8398150848448731
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.813228842989582
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[Fe].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7690853830022689
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.712243136905789
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[Fe+2].[K+].[K+].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.725429401171845
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.351514910274836
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.596356785263903
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.912803780460153
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[K+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9413144810332059
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.990461739945196
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[OH-],CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9107457974809461
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.869685852171353
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.959684303993261
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9394988029553081
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Fe].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9351595075097611
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.930578567469301
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Fe+2].[K+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7835621120431421
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.550019058291789
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.818629369868263
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.984242664555904
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Li+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.946976018111647
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9914708169669101
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Li+].[O-]C(C)(C)C,CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.924161915710919
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8863643191874
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9647941063340749
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.934379969374087
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Fe].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9185777455876369
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9276509437976359
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Fe+2].[Li+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.51045416899753
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.423735378679123
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.654905089572615
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.962958316166789
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.943763791256126
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.979833024580542
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,CCN(CC)CC,CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.855651934186358
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8325912020922409
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9432154986679709
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.848979196226979
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7988745393694611
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.723674569289408
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.69769453352364
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.302916015754925
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.460472423223681
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9087688255896219
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.798252312729648
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.861598365566837
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,,CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.61840326392814
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.584171299739657
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.719842756980722
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.636996109430719
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.622324872843968
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.482363623672125
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.48846961485259
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.16310090616227801
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.36346281424418897
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.875240083686633
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Na+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.863981327733766
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.91170968729632
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[OH-].[Na+],C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.751728804768018
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.736069841438197
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.925924935381104
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8141071464763889
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Fe].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7600656645196411
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.826882632651604
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Fe+2].[Na+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.425699415715324
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5717315076833409
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.822364158842793
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.955822292817741
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Na+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.942329208243244
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.914693063670746
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Na+].OC([O-])=O,C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.754171106157705
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.637994621407727
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8749727583621429
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.687877879150992
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Fe].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.512281776414129
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.569619858820029
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Fe+2].[Na+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.316533357416048
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.347240602162097
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.493830327515439
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.700980243579033
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Cs+].[F-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7319217021980811
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.793767763563565
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[F-].[Cs+],C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.647374833149791
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.513131590835915
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7373869691402559
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.509770825681794
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Cs+].[F-].[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.45021128540438
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.412084244002088
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Cs+].[F-].[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.274798555260015
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.251224559173225
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.356475675053292
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.626449193064634
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.632382170775438
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.727773514676318
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.538829294564947
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.46371360419785396
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.707014633702007
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.47468838080516496
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[Fe].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.483979615878383
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.43925515207870497
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[Fe+2].[K+].[K+].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.301285633962036
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.26265384135480596
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.36013158067660905
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.797740939295461
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[K+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7731612398144491
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8422806283437729
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[OH-],C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.68446213267915
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.648468788833468
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8612146288139969
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.737016952948523
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Fe].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.678392299383743
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7270795788829391
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Fe+2].[K+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.34329011030931605
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.48367637664478896
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.656954822014856
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9354786415934071
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Li+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.947130894737261
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9552727639976141
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8218784925881261
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.870434135174461
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9661162196145789
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.953415782669254
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Fe].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.802319711050195
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.936723772665667
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Fe+2].[Li+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.389627465193466
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.664073365906501
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8916600855005341
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.962539095257209
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.970914501027814
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.960017905650996
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,CCN(CC)CC,C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9029041682367019
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.848706034167385
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9484964236630791
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8537068500866719
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.697133789399681
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8034326797011271
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.380796733943818
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.457371982369901
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.676194611537279
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.89609719376382
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.889453950587196
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.899468449326943
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,,C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7755799141066401
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.657953216209245
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.86346395143195
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.679992345723152
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5820700337913081
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.61645116052751
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.38242229507649905
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.35706469160154003
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.450688444638412
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.747107367489958
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Na+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.88532284294614
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.930855007197971
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[OH-].[Na+],CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9380918025482881
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.824480351390072
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9460197666617699
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9108931243195011
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Fe].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8809380423862071
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.903412869547784
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Fe+2].[Na+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.23235472030493798
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.695565385435371
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.49413354851583596
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0975878431939576
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Na+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9309021460378539
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8863732815788881
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Na+].OC([O-])=O,CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.700526683935628
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6260972130438069
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.844858978893051
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7586564821341191
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Fe].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.55340408136272
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7262185634399999
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Fe+2].[Na+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.523618595877525
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.18777466411316102
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.38745340319309696
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0871938376765906
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Cs+].[F-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9092119342216379
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.918318109216193
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[F-].[Cs+],CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.82679711652724
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.777167898849177
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.946864418133215
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.825833913998959
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Cs+].[F-].[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.654211949280103
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.757049127480775
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Cs+].[F-].[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.800178129343554
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.208546302579408
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.45423818992716397
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.672050803870218
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8248900506078349
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.853787430856845
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6086750759806869
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.554336642740937
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8022891981750649
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.659115894046656
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[Fe].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.606225682272502
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.512806986262864
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[Fe+2].[K+].[K+].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.332179446989488
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.19124956407694899
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.40071601755191205
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.565577572317963
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[K+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9346339977676079
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.913490076349663
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[OH-],CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.936177290076976
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.821428956832824
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.941253984509341
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8889432790177141
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Fe].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.812116415511972
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.859595559123163
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Fe+2].[K+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.422352668094115
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.721694382931371
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.59380777959232
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.883293993186939
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Li+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.954927179445054
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9628217286477719
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.890252438637742
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8258021420756511
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9697081154376209
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.937907153740685
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Fe].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.833408706737341
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.821370367674715
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Fe+2].[Li+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.298366945744184
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6864108491491789
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.617916966268352
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.929553083325161
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.891461143519818
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.90808720851855
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,CCN(CC)CC,CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.769789541189289
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7133621601601661
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.864445852720067
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.730162610888146
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.699025228149654
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.727517695659985
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.32147956436223096
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.42094478858856904
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.314989415232435
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.909169612457583
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.951802310856127
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9578027588652129
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,,CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.628996998357009
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.516180680309116
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.745325442406221
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.55905079901377
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5266508524610071
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.44362265857243005
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.331165102409529
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.154613611576148
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.302758848928958
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.800180316247857
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Na+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8996333193812259
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9036418715831719
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[OH-].[Na+],CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.84380228086177
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.832549988558846
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8479990590974821
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.838977514718059
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Fe].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.749427798770225
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.810500694745825
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Fe+2].[Na+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8099167481429861
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.484150872239126
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.754720499943282
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7727317677025689
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Na+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8783915777015051
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.900727586381624
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Na+].OC([O-])=O,CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.865816582241256
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.868204767499704
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.837480902579149
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.825043652181915
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Fe].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6723494512757879
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8151626017666651
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Fe+2].[Na+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.798836204385111
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.46697068565097405
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.748954851450335
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.670780084524069
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Cs+].[F-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.679992271937513
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.756767912108961
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[F-].[Cs+],CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.774069125784292
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7291904038225
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.760810736907673
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.52179758534187
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Cs+].[F-].[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.509059845404208
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.496133732169736
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Cs+].[F-].[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.603397001213641
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.210869811958156
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.404005890123846
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.830418373777861
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.903565709926078
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.92580425598343
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8804493217180049
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8819228280512
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.911514820193712
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.889598857495884
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[Fe].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7754805910524961
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.85092178075327
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[Fe+2].[K+].[K+].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7878059433188029
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.397995572365253
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.754157913836285
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.809135379771421
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[K+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8321419329658789
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8380406604589641
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[OH-],CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.785633428373669
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.864020620342603
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8371445517063739
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.878139516657921
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Fe].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7848369568961879
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.823457149952457
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Fe+2].[K+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.848291348184061
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.750570288082755
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6807521838313051
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8592432291006069
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Li+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.923311863723015
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,1.0
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Li+].[O-]C(C)(C)C,CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8927423461524979
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,1.0
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.86188448296281
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,1.0
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Fe].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8871471742438619
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.919010709994208
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Fe+2].[Li+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8535396054362561
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.854205716095521
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.640959235700096
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.706510462667117
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.787705003461351
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.739561555015255
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,CCN(CC)CC,CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.840520696358255
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.721828507181212
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.735317109522169
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.764303161907336
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5972638395098631
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.783561095070292
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.678204655748234
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.587965982080213
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.493675205588431
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.413940946931951
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.47404119950166296
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.661405625629358
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,,CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.721646607047369
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.647277810747058
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,,CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.55705023218713
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.637472036760534
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.396867087040593
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.66051033651894
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.41899049473496497
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.398871882027571
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.25826927068334
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[OH-].[Na+],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.540920535044988
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[OH-].[Na+],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Na+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.898939852422203
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[OH-].[Na+],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.882290064473181
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[OH-].[Na+],CC#N.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.717396021770258
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[OH-].[Na+],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.757408794329119
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[OH-].[Na+],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8788820290160421
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[OH-].[Na+],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8563600968698659
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[OH-].[Na+],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Fe].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.713519512090794
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[OH-].[Na+],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.732138647871774
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[OH-].[Na+],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Fe+2].[Na+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6725799717039931
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[OH-].[Na+],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.38044734476952696
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[OH-].[Na+],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.28996397625965
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Na+].OC([O-])=O,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.609948873781767
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Na+].OC([O-])=O,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.[Na+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.682273517216589
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Na+].OC([O-])=O,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.668927498701853
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Na+].OC([O-])=O,CC#N.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.701439846392079
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Na+].OC([O-])=O,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.590381854005292
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Na+].OC([O-])=O,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.566810707673839
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Na+].OC([O-])=O,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.734970292338345
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Na+].OC([O-])=O,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.[Fe].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7091116335268011
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Na+].OC([O-])=O,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.604739468127168
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Na+].OC([O-])=O,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.[Fe+2].[Na+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.511416160070433
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Na+].OC([O-])=O,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[Na+].OC([O-])=O,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.100159789922027
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[F-].[Cs+],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[F-].[Cs+],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Cs+].[F-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.535099354598604
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[F-].[Cs+],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6832719782651709
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[F-].[Cs+],CC#N.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7286717144846839
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[F-].[Cs+],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.701337798276558
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[F-].[Cs+],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5749578160641751
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[F-].[Cs+],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.734038335755176
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[F-].[Cs+],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Cs+].[F-].[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6054644801926871
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[F-].[Cs+],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5838739897076001
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[F-].[Cs+],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Cs+].[F-].[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.367366437501859
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[F-].[Cs+],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[F-].[Cs+],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.09872846465816319
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.385609154498418
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.595864310522226
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.61853738797466
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.40109078335151305
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.351721275964495
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.48020061762583
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.537776320429293
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].[Fe].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.40118208055159
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.550280169495892
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].[Fe+2].[K+].[K+].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.400428794492232
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0996186850649028
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[OH-],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.540920535044988
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[OH-],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[K+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7081824881190321
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[OH-],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.817040225182311
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[OH-],CC#N.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7420469631882299
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[OH-],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.611004479356087
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[OH-],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.780891978694366
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[OH-],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.89929632660548
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[OH-],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Fe].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.742866091441001
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[OH-],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.706484578725807
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[OH-],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Fe+2].[K+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.38594434804813504
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[OH-],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.20335979781228
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[K+].[OH-],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.21305373404707598
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.920646733485587
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Li+].[O-]C(C)(C)C,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Li+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.730683075724633
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.852614518045575
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Li+].[O-]C(C)(C)C,CC#N.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.871234619226744
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Li+].[O-]C(C)(C)C,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.763932226467668
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Li+].[O-]C(C)(C)C,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7044982933587041
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Li+].[O-]C(C)(C)C,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.820774526988059
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Li+].[O-]C(C)(C)C,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Fe].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6777147861224541
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Li+].[O-]C(C)(C)C,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.772100376940361
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Li+].[O-]C(C)(C)C,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Fe+2].[Li+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.35278810333410704
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Li+].[O-]C(C)(C)C,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[Li+].[O-]C(C)(C)C,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.06741416138731669
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,CCN(CC)CC,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9187197312432219
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,CCN(CC)CC,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.86040232186205
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,CCN(CC)CC,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.811411959626159
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,CCN(CC)CC,CC#N.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5871192128692551
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,CCN(CC)CC,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.536923691788303
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,CCN(CC)CC,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.829199179933664
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,CCN(CC)CC,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.74653263183873
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],CCN(CC)CC,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.40374931202608005
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,CCN(CC)CC,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6057861192485791
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],CCN(CC)CC,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.482424359760645
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,CCN(CC)CC,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.08863254742591449
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,CCN(CC)CC,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.127026933618309
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.904140764813548
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.731057789140218
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.838908302867805
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,,CC#N.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.511273034712434
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.538504535819066
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7567261382585301
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.584625721569154
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.416713481036202
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.561391395746856
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.38480027671247496
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.111636366738022
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0953495376035401
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[OH-].[Na+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9158251882984559
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[OH-].[Na+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Na+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7876937120492
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[OH-].[Na+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9156565618629109
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[OH-].[Na+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7223045818725911
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[OH-].[Na+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.558968187248135
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[OH-].[Na+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.959869565780276
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[OH-].[Na+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.872360128876829
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[OH-].[Na+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Fe].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.61488521771366
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[OH-].[Na+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.792679734558002
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[OH-].[Na+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Fe+2].[Na+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.138140833999435
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[OH-].[Na+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.19772846952585202
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[OH-].[Na+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.069314202604836
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Na+].OC([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9475901629156699
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Na+].OC([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.[Na+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.84054790163906
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Na+].OC([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8302491932065099
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Na+].OC([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.510468530903619
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Na+].OC([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.571382266652478
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Na+].OC([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8779111266177639
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Na+].OC([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.588998141073101
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Na+].OC([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.[Fe].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.402356575343603
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Na+].OC([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.46824025856413004
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Na+].OC([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.[Fe+2].[Na+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.168990477442593
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Na+].OC([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0879331979589144
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[Na+].OC([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0383397584421714
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[F-].[Cs+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.627454593843346
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[F-].[Cs+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Cs+].[F-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.673395971164507
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[F-].[Cs+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7245076767750019
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[F-].[Cs+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.358635562025547
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[F-].[Cs+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.503057809270717
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[F-].[Cs+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.770157224798441
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[F-].[Cs+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.44121565736509
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[F-].[Cs+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Cs+].[F-].[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.388990395609926
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[F-].[Cs+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.352719551438374
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[F-].[Cs+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Cs+].[F-].[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.153532127786902
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[F-].[Cs+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0388993433542378
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[F-].[Cs+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0360888525222781
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.638600423016889
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.578342715185746
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.696042303984851
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.304947480541587
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.35363742950322297
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7659890024629781
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.430043335882556
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].[Fe].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.367830173819224
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.412965747708337
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].[Fe+2].[K+].[K+].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.195064395015793
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.10609253239583999
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0536038470460954
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[OH-],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.846337265031197
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[OH-],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[K+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6676846713934781
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[OH-],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.823323838216524
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[OH-],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.516797037521841
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[OH-],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.470931748804007
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[OH-],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.874938125845465
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[OH-],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.654910790551794
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[OH-],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Fe].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.456337979757376
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[OH-],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.585788176507977
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[OH-],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Fe+2].[K+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.232200764942077
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[OH-],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.20590769119239302
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[K+].[OH-],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0590316548586359
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.959562823315668
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Li+].[O-]C(C)(C)C,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Li+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.840743852094091
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.891623944753559
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Li+].[O-]C(C)(C)C,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.699316137913881
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Li+].[O-]C(C)(C)C,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.481599517628836
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Li+].[O-]C(C)(C)C,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.961897895055492
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Li+].[O-]C(C)(C)C,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8496072213244701
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Li+].[O-]C(C)(C)C,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Fe].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.446890074493298
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Li+].[O-]C(C)(C)C,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.627744625468968
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Li+].[O-]C(C)(C)C,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Fe+2].[Li+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.247735636010018
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Li+].[O-]C(C)(C)C,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.153102254392046
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[Li+].[O-]C(C)(C)C,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0389908287303162
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,CCN(CC)CC,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.96746795103067
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,CCN(CC)CC,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.895321925857556
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,CCN(CC)CC,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.835060849480762
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,CCN(CC)CC,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.735358960398878
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,CCN(CC)CC,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.502452795195059
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,CCN(CC)CC,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.940717773269755
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,CCN(CC)CC,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8701977509163601
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],CCN(CC)CC,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.495009136078122
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,CCN(CC)CC,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.779979899133337
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],CCN(CC)CC,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.13889930190410302
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,CCN(CC)CC,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.30627883989828897
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,CCN(CC)CC,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.043744395236820395
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9562732994440369
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.902810247642196
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8900814033147709
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.689350080444119
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5818819716945139
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.931498522158593
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.749380087976924
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.47666126785353696
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.628568385588947
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.161106035737868
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.206969893963096
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0552966671300205
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[OH-].[Na+],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7649779481890271
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[OH-].[Na+],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Na+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.737808586444618
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[OH-].[Na+],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.797022937556954
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[OH-].[Na+],CN(C)C=O.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.647761177713041
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[OH-].[Na+],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.245597182841315
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[OH-].[Na+],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.659494323923091
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[OH-].[Na+],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6599999599795321
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[OH-].[Na+],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Fe].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.47044039523102804
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[OH-].[Na+],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.347415795283047
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[OH-].[Na+],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Fe+2].[Na+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.140815058468064
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[OH-].[Na+],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.06496477951933011
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[OH-].[Na+],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0622527335265479
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Na+].OC([O-])=O,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.464702844454661
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Na+].OC([O-])=O,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.[Na+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6904309197716689
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Na+].OC([O-])=O,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.480652592350593
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Na+].OC([O-])=O,CN(C)C=O.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.51210799887072
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Na+].OC([O-])=O,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.148143117404816
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Na+].OC([O-])=O,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.49056454492762497
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Na+].OC([O-])=O,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.26040918815247
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Na+].OC([O-])=O,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.[Fe].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.211949923436969
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Na+].OC([O-])=O,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.22128896568118703
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Na+].OC([O-])=O,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.[Fe+2].[Na+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.137090810522631
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Na+].OC([O-])=O,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.032623200193116
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[Na+].OC([O-])=O,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.08059729070473921
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[F-].[Cs+],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.36025107618598295
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[F-].[Cs+],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Cs+].[F-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.731184305145627
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[F-].[Cs+],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.462696158969521
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[F-].[Cs+],CN(C)C=O.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.367498930707264
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[F-].[Cs+],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.247732016917544
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[F-].[Cs+],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7144688654899799
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[F-].[Cs+],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.46342640937807095
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[F-].[Cs+],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Cs+].[F-].[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.22253772771404498
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[F-].[Cs+],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.218679716073896
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[F-].[Cs+],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Cs+].[F-].[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.120016592145149
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[F-].[Cs+],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0395149617783057
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[F-].[Cs+],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0753180772643522
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.487276409549358
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.613793062008001
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5447246147945041
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.206432747388988
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.11813373683554901
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.542307156449755
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.291568163361999
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].[Fe].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.22115541465268498
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.154584201258111
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].[Fe+2].[K+].[K+].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.141894556574202
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0302396704995803
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0830006442709662
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[OH-],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.480559209732778
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[OH-],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[K+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6478311681004181
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[OH-],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6661592687659641
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[OH-],CN(C)C=O.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6782808811897679
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[OH-],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.30730199900877
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[OH-],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.647543840218683
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[OH-],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.639633723238879
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[OH-],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Fe].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.45039794518357296
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[OH-],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.435120520736486
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[OH-],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Fe+2].[K+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.134303280555806
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[OH-],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.14234484694871902
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[K+].[OH-],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.189442664281521
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7870692523977251
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Li+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7539382247574611
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6989466448873679
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6426614145509499
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.262645200113588
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.826188805431717
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.33943443595108697
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Li+].[O-]C(C)(C)C,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Fe].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.826188805431717
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.153187557376871
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Li+].[O-]C(C)(C)C,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Fe+2].[Li+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.13896108113473798
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0716311708385818
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0491099216253518
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,CCN(CC)CC,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8076436043349049
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,CCN(CC)CC,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.649049830329806
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,CCN(CC)CC,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.751753061215778
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,CCN(CC)CC,CN(C)C=O.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.49017442702604497
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,CCN(CC)CC,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0662394660290153
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,CCN(CC)CC,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.723208980104317
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,CCN(CC)CC,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.42803667132526596
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],CCN(CC)CC,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.268835220167975
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,CCN(CC)CC,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.120627554003008
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],CCN(CC)CC,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.072466164164885
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,CCN(CC)CC,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0918848220225247
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,CCN(CC)CC,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.057720264029925195
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.809411305338202
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.455436187281665
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.577619061384486
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,,CN(C)C=O.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.451100385219198
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.124369769954043
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.647975373042168
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.234740394455843
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.23113141899058
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.175720438479683
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.147856752476347
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0379601221483607
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.08827944580974309
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[OH-].[Na+],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.595869211694652
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[OH-].[Na+],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Na+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7910082593751749
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[OH-].[Na+],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6854225022364829
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[OH-].[Na+],CO.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.619182108960878
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[OH-].[Na+],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.640773246171434
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[OH-].[Na+],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6424571647554851
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[OH-].[Na+],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.540906393517141
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[OH-].[Na+],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Fe].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.25502302368400903
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[OH-].[Na+],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.528177029834646
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[OH-].[Na+],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Fe+2].[Na+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0904572769254407
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[OH-].[Na+],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0377677586966687
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[OH-].[Na+],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.428974736802609
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Na+].OC([O-])=O,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.315811337318611
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Na+].OC([O-])=O,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.[Na+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6846057174267279
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Na+].OC([O-])=O,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.561445045271822
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Na+].OC([O-])=O,CO.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.470705668983345
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Na+].OC([O-])=O,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.645715496753202
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Na+].OC([O-])=O,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.583275366477236
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Na+].OC([O-])=O,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.358094165591069
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Na+].OC([O-])=O,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.[Fe].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.17872632788702
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Na+].OC([O-])=O,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.296203866812903
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Na+].OC([O-])=O,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.[Fe+2].[Na+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.10281657080758301
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Na+].OC([O-])=O,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.022512295544019397
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[Na+].OC([O-])=O,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.194577717486751
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[F-].[Cs+],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.432704285718877
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[F-].[Cs+],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Cs+].[F-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.466820745667589
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[F-].[Cs+],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.512487615301835
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[F-].[Cs+],CO.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.245134022603973
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[F-].[Cs+],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.485113721138405
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[F-].[Cs+],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.42434406985811796
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[F-].[Cs+],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.178666157191774
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[F-].[Cs+],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Cs+].[F-].[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[F-].[Cs+],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.161852471350164
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[F-].[Cs+],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Cs+].[F-].[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.124359122318423
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[F-].[Cs+],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.014839714725258
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[F-].[Cs+],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0948424248908904
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.425514158959722
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6678044254090091
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6317090542536881
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.573047545816069
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.609014648889427
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.652874072865544
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5011864023457899
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].[Fe].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.277884154513842
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.43980945389189
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].[Fe+2].[K+].[K+].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0976601449382814
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0179404991984808
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.308047340497371
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[OH-],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.396326909475235
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[OH-],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[K+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7116621631175271
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[OH-],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.625901003557028
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[OH-],CO.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5971108362865121
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[OH-],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6767959773682379
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[OH-],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.690477404859142
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[OH-],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.606183333793201
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[OH-],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Fe].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.277396473154882
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[OH-],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.536436856390168
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[OH-],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Fe+2].[K+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.11945796955848101
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[OH-],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.00527912468979002
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[K+].[OH-],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.336228773736327
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.448044602309298
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Li+].[O-]C(C)(C)C,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Li+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.779213130159205
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.637659041002719
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Li+].[O-]C(C)(C)C,CO.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.698122924346663
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Li+].[O-]C(C)(C)C,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7158896789939421
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Li+].[O-]C(C)(C)C,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.588569154275866
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Li+].[O-]C(C)(C)C,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.515657854887724
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Li+].[O-]C(C)(C)C,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Fe].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.258919720932694
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Li+].[O-]C(C)(C)C,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.584537356209573
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Li+].[O-]C(C)(C)C,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Fe+2].[Li+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.09511864121036159
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Li+].[O-]C(C)(C)C,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0132221975332034
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[Li+].[O-]C(C)(C)C,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.29559721465017696
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,CCN(CC)CC,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.290959427043556
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,CCN(CC)CC,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.538966504380561
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,CCN(CC)CC,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.528178409893278
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,CCN(CC)CC,CO.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.23644544523272
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,CCN(CC)CC,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.566968894834854
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,CCN(CC)CC,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.581758364883022
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,CCN(CC)CC,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.249802345450057
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],CCN(CC)CC,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.144094099422302
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,CCN(CC)CC,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.17110177326432002
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],CCN(CC)CC,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.105162253126458
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,CCN(CC)CC,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.038192236461342996
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,CCN(CC)CC,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.134719672373391
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.239502535579356
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.3416656251117
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.42550393850987706
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,,CO.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.220128345776522
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.45800938650760203
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.440080731410714
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.21481226042581303
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.167406089975124
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.177712172114827
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.08940864746380321
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0205024563626456
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.124285362598183
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.011994038166815699
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Na+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.18935838051499299
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0401656971553394
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[OH-].[Na+],CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.164746680143826
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0261503867571083
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.15972671252428
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.418980306254446
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Fe].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.180216477223819
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5665716110947789
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Fe+2].[Na+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.194068857750423
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0125178380347857
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.17287546931308398
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.10725525147372
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Na+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.147391704665241
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.112240659899822
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Na+].OC([O-])=O,CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.127952766120511
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0660643327015147
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.129334697609275
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.76924402688556
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Fe].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.144444780962046
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.766092540402725
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Fe+2].[Na+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.22131998924322702
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0581714326273182
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.150811103538641
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0998495479326621
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Cs+].[F-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.138859858217239
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0766360081007827
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[F-].[Cs+],CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.139159300193246
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0779520587587677
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.151621150809192
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.72088283247455
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Cs+].[F-].[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.16641276697962698
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.777775757863656
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Cs+].[F-].[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.229215706950641
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.00944095392622653
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.14564985889808202
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.087309276280328
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.14016775406596899
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0967931777294212
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.125452894223222
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0578692333912203
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.15466958668018901
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.694164078627972
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[Fe].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.154927837625559
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.680519218040055
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[Fe+2].[K+].[K+].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.21195860669532401
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.009579968292291
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.165872668388656
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.104765812639733
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[K+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.138878617944491
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0809157710038664
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[OH-],CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.12105213826398399
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.06601540571882661
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.126420385996347
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.745397780882317
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Fe].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.159518092932657
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.811725460071156
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Fe+2].[K+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.207888093170631
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.00522685148097459
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.144219691387995
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.123907583067565
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Li+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.14631258596007402
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0869965651811787
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Li+].[O-]C(C)(C)C,CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.120026121044083
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0707575678856054
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.145072624201736
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.754951621434809
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Fe].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.148935851619062
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.765580614420357
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Fe+2].[Li+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.212734668519549
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.057118414668123396
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.114980970099218
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0927563517498969
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.14614273933251
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.101281453773855
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,CCN(CC)CC,CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.116013487285606
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.059292821927916003
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.144378254779288
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.72118145583544
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.143133366151467
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6773246240453329
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.237060297736621
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.055432354645104195
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.151963795206905
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.12158725404083899
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.143000335108066
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0887580128606084
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,,CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.12441524997735601
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0741429803690884
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.180563360671451
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6466270690403649
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.144811868348585
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.663693436136256
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.227624460517114
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.00442896511402934
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.14523254853373
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.220948823206334
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Na+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.16794346723837802
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.169435694840254
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[OH-].[Na+],C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.318588415954007
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.10921078149499801
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.499088585701545
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.784124864174597
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Fe].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.191356350540762
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.921586992235599
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Fe+2].[Na+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.28110615602099304
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0468684976756067
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.170427715381606
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.511318889283443
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Na+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.156288752625118
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.308867534362406
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Na+].OC([O-])=O,C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.487538022047724
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.07818749068235001
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.677962033099342
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.506622092531357
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Fe].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.181643115729666
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.564987863777223
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Fe+2].[Na+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.261044873752637
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.038781475078955
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.147624146477281
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.21185462014088402
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Cs+].[F-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.155459285810292
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.258106467403461
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[F-].[Cs+],C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.437752308026992
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.055634649879310605
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.483270816076639
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.46587854261935197
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Cs+].[F-].[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.193010010887499
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5755479477105669
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Cs+].[F-].[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.262076143500747
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0328342953469326
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.16841665434946598
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.30599503910659
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.16409725809707598
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.238159236468295
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.37156863099548404
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0644764795854343
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.46653625283774197
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.537176698377169
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[Fe].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.18313202262061498
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.683132515465746
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[Fe+2].[K+].[K+].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.25511125691123104
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0354059076082544
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.151605629013557
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.446338571272874
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[K+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.17782460577228001
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.252179093318411
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[OH-],C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.46213612963218204
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0762239229987642
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.33611680163124397
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.706705789591617
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Fe].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.221836020480512
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7993763891953379
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Fe+2].[K+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.28721040092551
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0456206774208026
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.20747790263427
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.529510152434429
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Li+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.182892233041311
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.151192034239659
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.185113368883629
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0906666542323443
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.30618049521742
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.771262037718349
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Fe].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.18223165974597
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.925289663983344
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Fe+2].[Li+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.318491579295088
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0350718475053777
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.233341547932659
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5857305324677999
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.18110092225316302
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.114717514841347
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,CCN(CC)CC,C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.15745215579989702
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0729734546571524
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.336974393630585
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7622440354629489
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.179262397210478
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.917637282185701
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.249842117194858
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0514344850139238
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.18446332107509503
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.511005377742195
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.174877961134686
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.310517660664837
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,,C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.51234272779709
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0684288029696772
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.770574012684736
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6929804582707411
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.193177627258165
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.84829543443316
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.24249963970119398
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0735429088462442
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.212056780187312
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.253391267800029
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Na+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.133206136403882
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.119300710239763
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[OH-].[Na+],CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.139178950610633
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0767713629354787
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.122949455798745
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.723828332961881
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Fe].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.184497562460196
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8653100856873011
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Fe+2].[Na+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.169961315834885
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0526135782679675
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.171882076974384
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.11134590635454099
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Na+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.17024995491507
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.08528387472561351
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Na+].OC([O-])=O,CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.324954010344593
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.06251696954397219
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.21791231311432502
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.464988288588876
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Fe].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.154480762420764
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.529348424626596
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Fe+2].[Na+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.244595044579894
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0058386750442791305
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.13338988812739902
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.042975683053356105
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Cs+].[F-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.163174193822416
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0925177884213519
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[F-].[Cs+],CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.311837712138121
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0596447605163282
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.21020938178632398
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.568578535603396
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Cs+].[F-].[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.16626888275670001
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.47979963470239395
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Cs+].[F-].[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.240776255302199
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.00560305606125589
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.127573867507533
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.12778903211057
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.1529332694984
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0931753002037266
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.262538649893708
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0724249243796525
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.20584835014678599
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.404291945086649
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[Fe].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.15784439073552
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.40456564565183695
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[Fe+2].[K+].[K+].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.247112538420999
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0059508730751396096
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[K+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.161887481233549
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.10767191562488
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[OH-],CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.140852192885319
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.07583614555221539
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.184708108012471
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.135319907640115
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Fe].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.18045048072818498
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.10452581264233
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Fe+2].[K+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.21854865986212002
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0737411353086134
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.16584023969693099
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.09537921803776041
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Li+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.14959748008031698
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.10978700781404999
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.13095564184075
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.08041335011427311
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.17256236835296102
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.123981992071494
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Fe].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.172579179473289
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.111300801891241
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Fe+2].[Li+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.21355838404611
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0647518145704488
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.122050797469804
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0584011060215166
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.156966544082588
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.09801818039946159
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,CCN(CC)CC,CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.131332444044815
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0818523886426928
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.161204859657885
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.107537614552375
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.173942781541442
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0990224675884415
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.22806152527498502
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0788061116630647
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.129098218911143
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0669124874096873
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.159272433860581
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0894332020348582
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,,CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.151547223949761
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.109182545406988
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.19533543094747302
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.15418249173578
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.16877203206110297
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.08474634243407211
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.243001073896368
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0847972125605049
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.139691696310488
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.20185935607839903
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Na+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.128456037208057
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0881983656269208
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[OH-].[Na+],CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.210690533833327
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0745025125131147
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.429834041719186
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.630567027454006
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Fe].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.139406202290719
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.589724928690913
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Fe+2].[Na+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.15368952366778
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0114247002564213
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.177386177835443
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.211987745133346
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Na+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.11907417009049799
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.122049802793206
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Na+].OC([O-])=O,CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.304880748110243
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0767297495504328
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.162716325438169
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.359372787401744
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Fe].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.131594440400603
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.34163821878954304
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Fe+2].[Na+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.154328565948889
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0537815028599075
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.15747495493741298
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.233940211864483
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Cs+].[F-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.11677342260852001
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.09804329920486748
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[F-].[Cs+],CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.180669504205091
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0814930684110489
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.217651827171444
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.14381208000394602
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Cs+].[F-].[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.169109138824936
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.161847436904213
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Cs+].[F-].[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.126909228440322
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0385756078294583
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.120843230526967
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.1569481779376
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.12043050267999901
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.10093742085826402
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.193495645498422
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0587430749692781
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.154224792783607
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.604457773137239
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[Fe].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.144413966784056
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5175293724064151
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[Fe+2].[K+].[K+].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.161295131125156
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.07555981668350259
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.144106811209717
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.153189390984768
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[K+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.11812347096108301
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.11199889148643001
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[OH-],CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.214170295948898
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0627505425888356
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.132933729352841
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.603987888424428
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Fe].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.145698319881619
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.608505861657784
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Fe+2].[K+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.171836017768633
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0685925842616394
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.162870326134265
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.17433097354723198
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Li+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.092060346046
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.127939614208456
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Li+].[O-]C(C)(C)C,CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.23447496201233498
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0806715497208743
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.21176161000513702
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.600166409624427
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Fe].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.165615487313444
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.655352270099713
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Fe+2].[Li+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.177416235342643
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.08533182056048551
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.16483857820639203
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.15054897026539701
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.11913424953653401
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.108727308233507
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,CCN(CC)CC,CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.221991561321321
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0669607059608773
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.234421381824155
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.188651287107215
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.131388937986527
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.16234048860405198
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.147294368192105
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0575063336835041
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.14210915649871
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.122285007142035
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.116077606719487
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.07195662028233149
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,,CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.150517470800588
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0786188377642378
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,,CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.197559419036668
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0961889860611315
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.108217609211578
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.10308002221350901
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.136338934880661
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0673702017075448
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.155312194455369
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.139813817502571
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0796618514464345
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.12283464395397001
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0724593769335972
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,,CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.057454807373373704
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0945582157026869
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0870577131696553
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0945561160805415
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.10979336965789001
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.106694105270891
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.15343959545684802
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.121591487850837
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.151387228001966
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.17903382796436
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Na+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.167577155104904
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.155264191505195
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[OH-].[Na+],CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.154482855869851
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.16579958039852902
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.170860943832161
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.156249280875702
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe].[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.185577496439466
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.168336656142609
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].[K+].[Na+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.193591027066034
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.15817425114025
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.18170754640549
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.135887462269256
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.132402803955205
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.120337584598898
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[OH-],CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.12969611802158199
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.12549630723454
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.142231025963931
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.088268058755857
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe].[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.11379667698737199
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.105906782556119
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].[K+].[K+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.166853434671347
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.10420765482893099
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.11585630834107499
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0969691544956879
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Li+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.166562808102567
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.137568454795212
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Li+].[O-]C(C)(C)C,CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.09290870160086209
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.10111472244841099
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.101786229144552
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0943287329586196
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe].[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.142051813957515
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.12719547706707598
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].[K+].[Li+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.140083193415379
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.11283108783287901
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.118436960539052
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.11547215359360599
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Na+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.15606472397909202
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.13445608059374
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Na+].OC([O-])=O,CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.116282541939316
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.118306017627577
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.156800503463876
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.105371402526377
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe].[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.14126972177302702
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.127478415502865
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].[K+].[Na+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.155420342478759
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.122513383007263
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.147116515867077
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.129602971695568
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.165418183464726
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.129683792074711
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,CCN(CC)CC,CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.104134473242587
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.139331516369427
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.129173039172971
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0989374412916546
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.119429670598749
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.121239115186235
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.18501258911695198
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.132111938776953
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.131992388672452
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.100810432302034
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-].[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.155577773911709
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.13247858997790002
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[F-].[Cs+],CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.102227443502833
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.13254834989220002
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.142723870689527
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.119325542618328
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-].[Fe].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.130226210099603
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.121894742651211
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-].[Fe+2].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.160311583180556
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.12883550179901898
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.11958029643450101
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.111180313310752
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+].[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.159475628558898
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.135083055354462
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.118936254506122
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.135471822094147
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.135472462282795
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.120542436465268
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.124496115641737
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.13520555856704
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].[K+].[K+].[K+].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.176607161889171
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.111442526407221
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.24955486203999702
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.14002081864653002
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.475932920393071
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.23862570849075201
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,,C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.605647504659502
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.20057249801141
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.212785957602165
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.240913953193732
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.35847133734216396
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.30498473353788996
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6977711427355869
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.168389113586287
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.19824960918115198
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.210940130700656
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Na+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7054882045642491
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.200578745072958
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[OH-].[Na+],C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.400135712199086
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.200322814801361
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.232392445652335
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.22404858242280198
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe].[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.328375782925033
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.300880746906032
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].[K+].[Na+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.293985213892106
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.172398359278094
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.19586931087571402
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.144924331536993
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.710899548475236
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.125532536846128
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[OH-],C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.415714510032228
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.175369378517119
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.174625403069894
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.16597607112100898
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe].[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.26286627686377
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.18409975504702397
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].[K+].[K+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.259188737218202
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.127250206566696
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.195931040205759
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.130291408114708
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Li+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.604681785931212
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.121985652582072
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.23167635140746298
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.14548943531178898
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.137487702335013
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.139619031882978
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe].[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.24363101478868698
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.152903976384162
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].[K+].[Li+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.16454262692342803
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.12231685803696299
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.152930413270299
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.16452675361006702
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Na+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.535380199567919
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.155892273464859
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Na+].OC([O-])=O,C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.443243261268643
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.152149277004721
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.24961278315545202
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.154145394024866
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe].[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.26796031679078697
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.194683756860681
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].[K+].[Na+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.757031991925831
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.13916359883622198
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.171021248390777
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.159984558083709
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.442487982595684
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.190891241836576
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,CCN(CC)CC,C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.611428273344365
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.16173364764184
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.237397722535834
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.232805123259458
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.327201930900508
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.210153415777165
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6286326041034961
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.149377364206417
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.17225602036673798
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.173863156318529
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-].[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.431343374789686
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.190715767020015
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[F-].[Cs+],C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.846404458728798
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.183648379644691
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.291162125068673
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.182730032417943
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-].[Fe].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.357445045713785
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.353915640277623
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-].[Fe+2].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.627090313204027
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.13451202055338402
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.295560779294257
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.20983005182968997
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+].[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.42261551191540003
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.18059995412435398
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.719583494589114
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.16849383222594402
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.30478264293137597
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.246953946753198
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.320271474984895
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.320663494954603
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].[K+].[K+].[K+].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.746494969270156
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.132711808023002
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.163092805790633
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.11285783261513499
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.151372759585714
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.105338934349014
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,,CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.119785920882898
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.120993094958254
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.120477516445614
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.122117178735198
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.16184629309707202
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.14923585948678
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.229104949880054
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.191463589152089
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.20618461939542299
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.18775448967855402
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Na+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.194799693510119
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.177875454059063
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[OH-].[Na+],CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.194959973250796
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.17961808373006702
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.184066392595125
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.17820722837733602
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe].[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.237261671520116
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.208382105453213
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].[K+].[Na+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.199426963541867
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.17261897723744402
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.121633085563089
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.18271032644894
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.11774973943610301
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.11430456944302801
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[OH-],CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.14019704831261
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.117386465958028
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.121963505729516
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.11937821695284499
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe].[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.137822083654791
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.233747434067799
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].[K+].[K+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.17004512908214997
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.128004588689694
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.14718328972451
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.123824430602611
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Li+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.130977039213548
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.104858120296492
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.114538628867978
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.11465645901780301
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.15883368444787402
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.111751592290316
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe].[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.257142604663828
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.117187583850453
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].[K+].[Li+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.16748110240482
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.12907972317108
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.234445137241161
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.117825525556778
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Na+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.14485147473463
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.11213000690492
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Na+].OC([O-])=O,CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.207748133896845
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.121980145262394
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.13036098100049698
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.11901048009976399
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe].[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.152347927569306
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.147257636749002
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].[K+].[Na+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.180184980055971
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.132271976492137
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.324224859369742
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.287347562512332
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.311659507499146
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.114763793107893
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,CCN(CC)CC,CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.295413906635846
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.138816279494787
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.30178158713650904
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.12930351447942098
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.164801757358596
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.16191901262883998
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.20159392406019103
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.13421825033162102
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.36912352935005205
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.116677258671328
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-].[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.324849579686562
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.108816834898281
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[F-].[Cs+],CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.13648055903009199
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.128005515183376
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.140470015401942
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.125338684615432
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-].[Fe].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.34917907379324803
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.330919911483077
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-].[Fe+2].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.172836310764969
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.128587415824765
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.12897160865105
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.118604916698108
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+].[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.137023790133604
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.11934596964050201
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.117905843376287
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.25413586291858303
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.33140230255811404
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.129610193720666
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.164853647722647
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.35782927368002704
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].[K+].[K+].[K+].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.436600285086756
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.135224115695209
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.199935756468829
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.245657867963505
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.480834590546864
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.549935857533148
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,,CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.260951520401067
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.38197917897582995
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,,CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7194564989348601
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.25892357024332296
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.211556122680987
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.276853289645105
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.283172580418119
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.146379906443844
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.436932180845099
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.23771607571147801
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Na+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.725634351152034
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.39107554295316604
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[OH-].[Na+],CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.615260085324535
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.356433689430426
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.35271204536302697
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.470332195697094
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe].[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.391730346342093
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.511744244009224
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].[K+].[Na+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.606823342257887
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.189618492130354
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.43881411396365005
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.20755355279881002
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.735172855597278
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.302209181780418
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[OH-],CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.49149158522478603
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.377236457267285
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.360519875321961
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.453801296707231
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe].[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.346066728020279
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.47377702424072704
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].[K+].[K+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.613352768812904
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.20338452854181502
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.460686127404338
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.208482959813437
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Li+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.744115583247324
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.254927639691642
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Li+].[O-]C(C)(C)C,CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.479197337735284
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.317840312964973
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.292140612239258
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5068947716819749
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe].[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.327250221410801
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.432173263787572
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].[K+].[Li+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.590579431186908
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.21745308009176198
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.402152246179884
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.213223108335775
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Na+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.836605274417068
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.368170703978088
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Na+].OC([O-])=O,CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.630475459489068
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.370532937563623
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.407782361962649
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5327533879578941
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe].[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.158552079794361
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.46272784431897
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].[K+].[Na+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.504156901344273
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.21574999337442802
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.372376986279346
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.182891137348556
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.713114005882294
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.310094996993573
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,CCN(CC)CC,CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.692606060621488
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.375888013957429
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.379102600856248
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.23204759834216301
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.162061966918441
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.306201453950248
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.35993234583830996
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.13429806376012599
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.41066516515211804
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.23648682753069403
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-].[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.629490622962332
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.453235270032473
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[F-].[Cs+],CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.83058392216765
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.384242718546827
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.433014167346659
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.277926170575499
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-].[Fe].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.18118379562360298
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.48346794238323904
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-].[Fe+2].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.372498339322766
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.150864088499012
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.37728791091416
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.205888434810722
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+].[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8453629929334671
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.312803530491708
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.646273988097727
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.44628499615843503
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.315100055067856
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.527824422076565
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.187506938512069
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.426209630103521
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].[K+].[K+].[K+].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6654690133323651
C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.182188665111988
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.156881688723221
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.147780268354717
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.15691686650067
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.16014599064044
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,,CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.193499384114338
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.173705755341663
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.151558847402676
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.144800539327886
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Fe].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.195034311457582
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.16116513737701202
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Fe+2].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.18161897560419699
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.145720403177964
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.17932047035925097
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.178158752599758
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[Na+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.194600541890312
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.206713011262588
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[OH-].[Na+],CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.196401573018221
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.295345148422211
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.194152903559553
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.191489948203758
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Fe].[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.25266914044822497
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.20139128134188
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Fe+2].[K+].[Na+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.206834625640573
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.19955862892443801
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.196957307857286
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.18855817152668902
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[K+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.161174354557888
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.166350881112689
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[OH-],CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.160654647028531
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.179719265622092
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.176066747426996
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.173086383948149
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Fe].[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.184246936533001
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.169247001261907
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Fe+2].[K+].[K+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.232558821726605
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.19222195368185102
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.198008071912585
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.167247505821641
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[Li+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.189124870841653
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.163535285776771
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Li+].[O-]C(C)(C)C,CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.158968116377885
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.36679144319855406
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.24067106222491097
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.16431016550459798
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Fe].[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.22383297180884798
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0465579277680126
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Fe+2].[K+].[Li+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.20823404027349401
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.160562107671994
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.159489733167676
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.158251177191189
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=C([O-])O.[K+].[Na+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.153395319557996
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.150921203104379
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Na+].OC([O-])=O,CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.15734755330484199
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.136122592797861
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.156169338834515
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.15392029829346401
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Fe].[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.19058290928389598
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.14067462658379
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Fe+2].[K+].[Na+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.195163272465481
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.122274411120822
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.170559523269666
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.16003758479205601
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.162314310996198
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.124024892036141
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,CCN(CC)CC,CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.143231355152906
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.155884542821281
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.16371397401874
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.13246941138993099
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Fe].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.159972703865402
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.157975197629559
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Fe+2].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.202955310077288
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.124810898939066
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.144360136738683
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.17172177020269402
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Cs+].[F-].[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.19751730697111403
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.1293833150216
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[F-].[Cs+],CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.14180829721977
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.15690943311487499
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.225052598289871
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.151384181472258
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Cs+].[F-].[Fe].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.154376725348955
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.14170070484359
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Cs+].[F-].[Fe+2].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.22454901270317498
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.166626585995442
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.167894257622833
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.141382460560395
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.151927559954978
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.164935027479413
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.160208015093494
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.152485521100638
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.135281321205867
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.14335160487124
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[Fe].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.16430799016293002
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.152729378493191
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[Fe+2].[K+].[K+].[K+].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.191997905447476
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.152034708178685
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.267901931378176
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.317632771207974
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.516819475304057
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.375697415498692
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,,C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.475966671471257
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.34745813576102597
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.551125757011294
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.31846512932745896
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Fe].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.356248309679565
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.299206692293622
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Fe+2].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.382874115019426
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.255131456221865
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.27403374583058
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.271610137965696
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[Na+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.4769994280623
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.43302628010597305
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[OH-].[Na+],C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.443966039489299
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.341056485272955
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.464292129672355
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.275793676986704
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Fe].[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.333054087721085
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.23646951512352798
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Fe+2].[K+].[Na+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.305757997925851
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.260619130236653
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.19679062879263298
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.212642371990921
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[K+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.424386394690166
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.30952782309096
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[OH-],C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.273066834835241
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.348184114690091
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.563663730831563
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.27033477708694603
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Fe].[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.311776658400704
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.233978021847755
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Fe+2].[K+].[K+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.354943203363119
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.173050673542388
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.204062691971075
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.221209733993878
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[Li+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.344878315370157
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.36441448724226605
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.32766309536337096
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.35008204010073596
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.41140013464872704
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.238887932749006
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Fe].[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.322212190472954
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.23111664415671002
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Fe+2].[K+].[Li+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.257804985060659
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.16569573280956
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.248053192516976
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.264418397567262
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=C([O-])O.[K+].[Na+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.42519879881738
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.27309904762991
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Na+].OC([O-])=O,C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.239628024638645
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.373369532390744
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.49386037101096003
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.228496111277808
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Fe].[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.299080836297566
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.242582885189593
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Fe+2].[K+].[Na+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.311506427876105
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.164915296666167
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.225217348449113
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.26609639010853103
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.47165566499761197
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.419652355246745
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,CCN(CC)CC,C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.305644301177783
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.37911178410335306
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.602988302760986
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.303094891905861
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Fe].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.353114738368117
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.290339311536707
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Fe+2].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.348398268565955
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.209756470176704
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.22816167384215
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.29098942790543203
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Cs+].[F-].[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5376700140082911
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.427549855077323
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[F-].[Cs+],C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.38709954528621504
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.354156522963782
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6006585804645259
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.320402589891117
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Cs+].[F-].[Fe].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.410559694365097
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.2883239162528
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Cs+].[F-].[Fe+2].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.398662967636342
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.233310415661207
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.21243132676676202
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.23754197934025
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.558914816206912
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.449804032016286
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.433202169693786
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.40649915648222396
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.581992783162919
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.307564235196156
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[Fe].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.37837691469161905
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.315059851578663
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[Fe+2].[K+].[K+].[K+].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.387094371708939
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.22201019367167898
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.149059398677293
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.130542278995477
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.15861162801435602
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.21990776861462902
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,,CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.175308015431549
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.147945756547157
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.139658476451378
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.148945288409416
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Fe].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.23057431120455898
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.223901076122702
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Fe+2].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.233784327214012
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.145555510169496
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.23665739528023402
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.16212147075983002
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[Na+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.20233016292171999
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.19903109699024
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[OH-].[Na+],CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.168580436947127
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.19216084227149502
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.188321502719919
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.186582556149359
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Fe].[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.27324760690544897
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.19778784940576302
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Fe+2].[K+].[Na+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.294189858956879
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.179146053904125
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.153130560291833
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.19091078697154198
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[K+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.16585095354894602
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.138155557367
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[OH-],CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.166681887407604
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.206109796757417
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.158467335228627
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.147033641087878
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Fe].[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.22403857154667
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.165083402583799
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Fe+2].[K+].[K+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.19722751496206
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.17541575898404801
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.145659678718254
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.188663752276703
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[Li+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.151668044289183
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.12522938504112602
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.14037304774353498
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.144100134248879
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.14158622948775
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0888771532362329
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Fe].[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.156419893960582
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0586580903274626
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Fe+2].[K+].[Li+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.180297440130328
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.118240958016408
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.152511670292274
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.148491968293494
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=C([O-])O.[K+].[Na+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.152368803804395
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.137459976380914
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Na+].OC([O-])=O,CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.134980268015851
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.159260488234943
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.149375503579623
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.138892949041685
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Fe].[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.154867170507133
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.151534675503182
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Fe+2].[K+].[Na+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.193633831981644
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.148133327105075
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.178300016286417
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.153324535019382
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.155674245092998
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.14340035743036
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,CCN(CC)CC,CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.16559451072283402
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.14666445164957
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.131039120692299
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.14385334677654002
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Fe].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.16304158016128198
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.15629066761853902
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Fe+2].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.17463483259776003
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.154332684035717
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.143635950523749
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.134561364248408
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Cs+].[F-].[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.150952684873105
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.131377975189612
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[F-].[Cs+],CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.147316185510617
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.144507658656202
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.19575400124515902
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.136084387569873
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Cs+].[F-].[Fe].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.279478531558983
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.15964708931255
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Cs+].[F-].[Fe+2].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.19508588153936401
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.163261983744739
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.140999504250751
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.315747261529548
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.19084837584446301
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.267728849060903
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.136915461041426
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.141292603914138
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.145537168323904
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.313482251595535
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[Fe].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.343718624816686
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.15824820763377
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[Fe+2].[K+].[K+].[K+].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.39416801851011896
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.14265278666762898
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.284952020661514
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.164443472478812
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.565604437882675
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.451715878483393
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,,CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.218786447398918
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.562904853106707
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,,CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.43944906343949397
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.296731068807604
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Fe].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.272605300677344
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.301439605561664
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Fe+2].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.371767710759476
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.195553399998139
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.546793661911336
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.48302750464649596
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[Na+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7517771023334321
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.630354014912605
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[OH-].[Na+],CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.750566199656418
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7214999762466909
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.703077737334652
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.625704687145466
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Fe].[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5327788409520999
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.619532903371179
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Fe+2].[K+].[Na+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.699954687958913
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.48046494342210105
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.555509404106655
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.42644654454378
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[K+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.693909615131461
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.600701933742825
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[OH-],CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6864463532986611
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.699205879445981
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.640428212149805
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.510815096478882
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Fe].[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.573464860772497
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5792413995551811
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Fe+2].[K+].[K+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6388375994162621
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.499399488188488
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6233176855427179
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.44225499879374197
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[Li+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7830729221413629
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.614808968074545
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Li+].[O-]C(C)(C)C,CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7372110799891319
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.732366037014242
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.634211190262383
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.698226988849497
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Fe].[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.542186905963502
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.64548881757529
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Fe+2].[K+].[Li+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.767321761861174
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.623763996706254
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.658414540762397
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.530919246082213
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=C([O-])O.[K+].[Na+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8148210660589611
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.701449301402921
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Na+].OC([O-])=O,CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.699503085016821
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.806547188959674
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.822284092138906
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.663970082094299
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Fe].[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5750588960604199
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6102969245973661
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=C([O-])O.[Fe+2].[K+].[Na+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.759982892387165
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.519097806824974
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5552005055233891
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.466139037102528
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8009402713730069
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7474210702938371
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,CCN(CC)CC,CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7390905763055051
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.793981316603031
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.812458349131119
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5874833553888741
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Fe].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.509265262934118
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.443453518104686
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Fe+2].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.680510194454965
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.348500681171297
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6204593397346401
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5381931235477839
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Cs+].[F-].[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.829046166312952
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7892409174916569
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[F-].[Cs+],CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6613375278905551
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.847733854491986
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.749555518376032
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.594661586003598
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Cs+].[F-].[Fe].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6065132412730709
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.508693311192704
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Cs+].[F-].[Fe+2].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.686230574433106
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.39216159409312
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.590365709597526
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.497427052492114
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7890208457450361
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7076744751335631
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.785853448223002
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7181859184659509
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.769818268296818
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.685057573371533
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[Fe].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.664300763091381
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.670199222196961
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[Fe+2].[K+].[K+].[K+].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7112102794138709
C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.408769317904903
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.165303321260305
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.12410720957001199
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.230208433871824
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.20702724562660102
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,,CC#N.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.129376085216106
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.152323973593782
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.147878278593665
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.13011301913555498
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Fe].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.222685236228263
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.13876671724071302
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Fe+2].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.173273157267264
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.133237650172296
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[OH-].[Na+],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.186962773997355
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[OH-].[Na+],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.15813947030338
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[OH-].[Na+],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Na+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.18178324347237398
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[OH-].[Na+],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.174453874590467
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[OH-].[Na+],CC#N.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.178627565009368
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[OH-].[Na+],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.172900536225997
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[OH-].[Na+],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.189611927112506
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[OH-].[Na+],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.177898057975307
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[OH-].[Na+],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Fe].[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.178124356775525
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[OH-].[Na+],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.212559661994207
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[OH-].[Na+],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Fe+2].[K+].[Na+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.209957159459615
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[OH-].[Na+],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.19118278091526603
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[K+].[OH-],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.12925239901017702
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[OH-],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.121712675259246
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[OH-],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[K+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.177479626288931
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[OH-],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.13162837104025202
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[OH-],CC#N.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.109904059371559
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[OH-],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.124102508459562
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[OH-],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.14153984925477
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[OH-],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.12904770851569
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[OH-],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Fe].[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.19908874942374802
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[OH-],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.12006488759676599
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[OH-],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Fe+2].[K+].[K+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.20903295355815799
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[OH-],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.12347997567963001
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[Li+].[O-]C(C)(C)C,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.13065348101361698
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.14142066300106002
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Li+].[O-]C(C)(C)C,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Li+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.22091361045125701
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.115397564506299
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Li+].[O-]C(C)(C)C,CC#N.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.10100480686234899
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Li+].[O-]C(C)(C)C,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.10874130757035401
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Li+].[O-]C(C)(C)C,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.11881057125102
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Li+].[O-]C(C)(C)C,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.13927412066974
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Li+].[O-]C(C)(C)C,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Fe].[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.16779765609819802
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Li+].[O-]C(C)(C)C,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.128928002461428
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Li+].[O-]C(C)(C)C,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Fe+2].[K+].[Li+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.227096687770233
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Li+].[O-]C(C)(C)C,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.129703284223806
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[Na+].OC([O-])=O,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.12408013771842401
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Na+].OC([O-])=O,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.101791355231639
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Na+].OC([O-])=O,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.[K+].[Na+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.144775564121699
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Na+].OC([O-])=O,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.231223215507468
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Na+].OC([O-])=O,CC#N.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.30877428236063603
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Na+].OC([O-])=O,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.150513912667319
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Na+].OC([O-])=O,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.15784512966748
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Na+].OC([O-])=O,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.137881721435859
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Na+].OC([O-])=O,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.[Fe].[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.134639376484243
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Na+].OC([O-])=O,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.127203172978365
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Na+].OC([O-])=O,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.[Fe+2].[K+].[Na+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.207260570344574
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Na+].OC([O-])=O,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.125096780136704
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,CCN(CC)CC,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.129963117255977
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,CCN(CC)CC,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.119746106912651
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,CCN(CC)CC,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.154286862804683
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,CCN(CC)CC,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.144666755535584
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,CCN(CC)CC,CC#N.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.13339244600321198
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,CCN(CC)CC,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.130403530502945
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,CCN(CC)CC,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.14290912412724
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,CCN(CC)CC,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.124794001332314
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],CCN(CC)CC,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Fe].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.16043775511085598
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,CCN(CC)CC,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.12467561854787
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],CCN(CC)CC,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Fe+2].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.210364006564294
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,CCN(CC)CC,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.12705843124081398
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[F-].[Cs+],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.139558749461689
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[F-].[Cs+],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.150919841109037
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[F-].[Cs+],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Cs+].[F-].[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.164250487565644
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[F-].[Cs+],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.128917091201748
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[F-].[Cs+],CC#N.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.11288976335048201
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[F-].[Cs+],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.138230680892582
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[F-].[Cs+],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.148776957978118
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[F-].[Cs+],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.122010010560295
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[F-].[Cs+],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Cs+].[F-].[Fe].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.14088859016586
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[F-].[Cs+],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.130440950688018
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[F-].[Cs+],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Cs+].[F-].[Fe+2].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.212683975574131
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[F-].[Cs+],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.128320495720887
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.16924869749848298
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.128602628892346
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.177682777679585
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.178764241294788
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.129875924442688
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.135260942374049
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.13827473510766
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.126760654995039
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].[Fe].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.15901689030784
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.128343307240686
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].[Fe+2].[K+].[K+].[K+].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.214523223557977
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.125457099664959
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.157667180386815
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.206909012249903
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.53112336492035
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.464640149627061
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.183771051234799
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.201381564304942
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.586909428325632
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.139953394600167
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Fe].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.30893041443096403
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.16742966566523398
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Fe+2].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.246346603971697
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.156408520779533
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[OH-].[Na+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.235191941540809
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[OH-].[Na+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.177034758199175
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[OH-].[Na+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Na+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.32102587858951204
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[OH-].[Na+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.178705829394058
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[OH-].[Na+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.187165126061604
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[OH-].[Na+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.163200246509561
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[OH-].[Na+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.17766922659123702
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[OH-].[Na+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.164910394585762
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[OH-].[Na+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Fe].[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.233365464539622
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[OH-].[Na+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.160683218788889
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[OH-].[Na+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Fe+2].[K+].[Na+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.204948051760428
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[OH-].[Na+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.179807085872222
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[K+].[OH-],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.14821702539846998
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[OH-],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.28529801166053004
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[OH-],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[K+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.37863930726740797
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[OH-],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.246935860610764
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[OH-],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.160245688357878
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[OH-],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.175264808917886
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[OH-],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.19016909525014
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[OH-],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.153649546161143
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[OH-],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Fe].[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.254619907651635
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[OH-],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.16517800337480298
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[OH-],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Fe+2].[K+].[K+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.21252605131994698
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[OH-],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.157578506124017
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[Li+].[O-]C(C)(C)C,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.172404232240611
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.183973693067571
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Li+].[O-]C(C)(C)C,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Li+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.32604029480136704
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.210122990379066
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Li+].[O-]C(C)(C)C,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.14751984437504398
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Li+].[O-]C(C)(C)C,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.222467564537038
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Li+].[O-]C(C)(C)C,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.213897561202857
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Li+].[O-]C(C)(C)C,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.154080483345732
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Li+].[O-]C(C)(C)C,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Fe].[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.258564502811331
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Li+].[O-]C(C)(C)C,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.20144868884356398
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Li+].[O-]C(C)(C)C,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Fe+2].[K+].[Li+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.277164055819481
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Li+].[O-]C(C)(C)C,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.175951478268442
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[Na+].OC([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.202544573766243
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Na+].OC([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.196395921780882
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Na+].OC([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.[K+].[Na+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.372267218939317
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Na+].OC([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.208181722101892
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Na+].OC([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.18826680471827997
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Na+].OC([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.18349306401322502
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Na+].OC([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.33483756476571697
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Na+].OC([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.16156218485363802
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Na+].OC([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.[Fe].[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.27890865796779296
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Na+].OC([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.174101567797745
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Na+].OC([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.[Fe+2].[K+].[Na+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.241696035865454
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Na+].OC([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.200890295044399
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,CCN(CC)CC,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.190835388316796
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,CCN(CC)CC,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.229271419587939
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,CCN(CC)CC,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5768273704741209
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,CCN(CC)CC,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.406524822352502
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,CCN(CC)CC,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.203814390190546
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,CCN(CC)CC,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.17773089943237502
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,CCN(CC)CC,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.578852205235802
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,CCN(CC)CC,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.170363838720475
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],CCN(CC)CC,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Fe].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.337383053552015
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,CCN(CC)CC,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.159999333401678
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],CCN(CC)CC,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Fe+2].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.284109264591555
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,CCN(CC)CC,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.183607159457543
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[F-].[Cs+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.217315177162737
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[F-].[Cs+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.252036778910408
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[F-].[Cs+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Cs+].[F-].[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.475451490150284
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[F-].[Cs+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5213425677285151
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[F-].[Cs+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.248094737496901
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[F-].[Cs+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.20897080362469603
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[F-].[Cs+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5720649300870381
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[F-].[Cs+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.17199146002277602
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[F-].[Cs+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Cs+].[F-].[Fe].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.397215404385379
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[F-].[Cs+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.18907503014870802
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[F-].[Cs+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Cs+].[F-].[Fe+2].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.266706662761019
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[F-].[Cs+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.18809852952609302
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.207308113268397
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.280661395808034
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.674856067345959
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.500508182027367
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.20766352159558402
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.20877431744220198
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.676100198682185
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.172964046576797
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].[Fe].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.377755339223614
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.16232470970772098
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].[Fe+2].[K+].[K+].[K+].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.23671133226980398
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.17323861638139998
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.137846800353616
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.12022257645825199
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.137221830615036
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.124650690131646
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,,CN(C)C=O.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.116543858946689
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.138955671263702
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.135624211918866
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.137450452588558
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Fe].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.153592610620309
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.142996032138205
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Fe+2].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.221398876701656
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.131605471106343
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[OH-].[Na+],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.18786481856069698
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[OH-].[Na+],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.16900391641559998
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[OH-].[Na+],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Na+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.183002220540458
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[OH-].[Na+],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.17093277094703702
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[OH-].[Na+],CN(C)C=O.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.186385110186351
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[OH-].[Na+],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.20274016370864
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[OH-].[Na+],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.22529141351145798
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[OH-].[Na+],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.173226162500905
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[OH-].[Na+],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Fe].[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.212802639968391
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[OH-].[Na+],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.17090174162767202
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[OH-].[Na+],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Fe+2].[K+].[Na+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.23593640701489602
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[OH-].[Na+],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.19346238624056
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[K+].[OH-],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.144810033510321
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[OH-],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.130352717241765
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[OH-],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[K+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.135079650171132
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[OH-],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.123630571590628
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[OH-],CN(C)C=O.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.140571181085843
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[OH-],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.14221661349742798
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[OH-],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.137385358653544
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[OH-],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.14104676177671802
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[OH-],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Fe].[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.155344632065188
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[OH-],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.141032999235711
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[OH-],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Fe+2].[K+].[K+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.208831981475224
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[OH-],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.153312232304861
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.137638644736428
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.144813013548654
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Li+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.179882638902038
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.11604469621054299
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.12440979510537799
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.162675009284686
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.123641252111026
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.13531307330593
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Li+].[O-]C(C)(C)C,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Fe].[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.165722622140949
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.13497177200251198
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Li+].[O-]C(C)(C)C,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Fe+2].[K+].[Li+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.190417798225373
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.12835035918544901
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[Na+].OC([O-])=O,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.138504215739468
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Na+].OC([O-])=O,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.13118209231021902
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Na+].OC([O-])=O,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.[K+].[Na+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.152298560409573
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Na+].OC([O-])=O,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.118322516796093
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Na+].OC([O-])=O,CN(C)C=O.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.130859463834636
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Na+].OC([O-])=O,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.137689996143366
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Na+].OC([O-])=O,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.121442001384959
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Na+].OC([O-])=O,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.126152135765429
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Na+].OC([O-])=O,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.[Fe].[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.136768837944507
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Na+].OC([O-])=O,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.140776301663524
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Na+].OC([O-])=O,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.[Fe+2].[K+].[Na+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.19800483303136399
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Na+].OC([O-])=O,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.139300385998948
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,CCN(CC)CC,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.17560042818593
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,CCN(CC)CC,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.132149792109131
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,CCN(CC)CC,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.157094027542723
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,CCN(CC)CC,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.126149698821401
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,CCN(CC)CC,CN(C)C=O.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.127775784469084
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,CCN(CC)CC,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.147437208357412
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,CCN(CC)CC,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.138664369591983
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,CCN(CC)CC,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.133651056586886
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],CCN(CC)CC,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Fe].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.157275061072589
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,CCN(CC)CC,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.145750959734398
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],CCN(CC)CC,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Fe+2].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.23861122825334602
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,CCN(CC)CC,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.14073354362332702
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[F-].[Cs+],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.144128895658084
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[F-].[Cs+],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.12491448637542801
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[F-].[Cs+],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Cs+].[F-].[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.203585618551679
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[F-].[Cs+],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.130122255451101
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[F-].[Cs+],CN(C)C=O.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.13938965531279998
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[F-].[Cs+],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.144832608653352
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[F-].[Cs+],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.141413943090496
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[F-].[Cs+],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.131436049106743
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[F-].[Cs+],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Cs+].[F-].[Fe].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.155339789140177
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[F-].[Cs+],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.136899778981536
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[F-].[Cs+],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Cs+].[F-].[Fe+2].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.21553239871143098
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[F-].[Cs+],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.147027602311817
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.138428090633842
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.131499948254695
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.161427979179794
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.122590170781746
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.14596984024445
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.143544170010869
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.15342122739438602
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.13637135332914402
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].[Fe].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.147456926157356
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.147816360379137
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].[Fe+2].[K+].[K+].[K+].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.217159773434973
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.150921258786779
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.308741632604921
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.561454745054319
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.48501358184273596
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.621212181554759
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,,CO.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.20205564444607
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.747085038250401
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.604833747943336
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.189062677804161
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Fe].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.256090339098859
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.292240501882185
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Fe+2].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.236268915989399
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.139920924049399
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[OH-].[Na+],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.288868762610549
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[OH-].[Na+],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.38524861166741403
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[OH-].[Na+],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Na+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.589432338594002
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[OH-].[Na+],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.463216103136523
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[OH-].[Na+],CO.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.272909202293205
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[OH-].[Na+],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.51257470425806
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[OH-].[Na+],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.447847849075776
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[OH-].[Na+],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.470211120779634
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[OH-].[Na+],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Fe].[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.247171760029062
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[OH-].[Na+],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.412883698922374
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[OH-].[Na+],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Fe+2].[K+].[Na+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.12889468871439902
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[OH-].[Na+],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.23839350060696698
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[K+].[OH-],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.40656923874167
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[OH-],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.46827426269938
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[OH-],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[K+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6815363014425211
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[OH-],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5798082323743791
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[OH-],CO.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.310766415402017
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[OH-],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.74837727223048
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[OH-],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6667490708710759
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[OH-],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.510382743640328
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[OH-],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Fe].[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.440824501093761
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[OH-],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.49825519937826895
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[OH-],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Fe+2].[K+].[K+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.35627107312226897
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[OH-],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.139645623316443
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[Li+].[O-]C(C)(C)C,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.41011994285444797
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.39954284239158605
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Li+].[O-]C(C)(C)C,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Li+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.731179926465945
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0665067279893314
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Li+].[O-]C(C)(C)C,CO.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Li+].[O-]C(C)(C)C,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.630085606622623
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Li+].[O-]C(C)(C)C,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.618445482535692
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Li+].[O-]C(C)(C)C,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.594301197359005
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Li+].[O-]C(C)(C)C,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Fe].[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.585738011874635
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Li+].[O-]C(C)(C)C,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.583938754579828
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Li+].[O-]C(C)(C)C,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Fe+2].[K+].[Li+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.58488378693634
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Li+].[O-]C(C)(C)C,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5975410213911581
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[Na+].OC([O-])=O,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.592428419134598
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Na+].OC([O-])=O,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.576557740224179
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Na+].OC([O-])=O,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.[K+].[Na+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.40923926863244
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Na+].OC([O-])=O,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.527397029495539
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Na+].OC([O-])=O,CO.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.354142356240434
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Na+].OC([O-])=O,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7405240275658891
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Na+].OC([O-])=O,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.574366346899551
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Na+].OC([O-])=O,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.39324777704102604
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Na+].OC([O-])=O,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.[Fe].[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.26955761594691496
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Na+].OC([O-])=O,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.460255781894583
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Na+].OC([O-])=O,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.[Fe+2].[K+].[Na+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.267190463615463
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Na+].OC([O-])=O,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.14242800862372001
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,CCN(CC)CC,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.200951285548444
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,CCN(CC)CC,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.408003469985751
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,CCN(CC)CC,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.641131169504598
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,CCN(CC)CC,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.57236121169228
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,CCN(CC)CC,CO.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.17866928818871
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,CCN(CC)CC,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7198744557739769
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,CCN(CC)CC,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.656939035520421
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,CCN(CC)CC,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.21099551458945
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],CCN(CC)CC,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Fe].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.211341210685597
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,CCN(CC)CC,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.2485572101321
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],CCN(CC)CC,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Fe+2].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.254938791640752
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,CCN(CC)CC,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.139491347637
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[F-].[Cs+],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.341057544244803
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[F-].[Cs+],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5708450175436429
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[F-].[Cs+],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Cs+].[F-].[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.647314378248345
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[F-].[Cs+],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.711663865106315
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[F-].[Cs+],CO.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.280118513675815
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[F-].[Cs+],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.743355724189074
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[F-].[Cs+],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.566792016786544
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[F-].[Cs+],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.32231841324043203
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[F-].[Cs+],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Cs+].[F-].[Fe].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.395027847665864
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[F-].[Cs+],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.33453374866200103
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[F-].[Cs+],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Cs+].[F-].[Fe+2].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.238316419608784
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[F-].[Cs+],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.136080348259786
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.38079900731110894
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.458146971357405
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7219237413182501
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.529200687349179
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.283156458852862
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.688556788386141
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.594357633096213
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.547958929854348
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].[Fe].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.336034884225437
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.425483758796606
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].[Fe+2].[K+].[K+].[K+].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.413122287051186
C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.139692311862331
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.242041020608554
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.16562555427869602
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.195766539161988
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.170942057280374
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,,CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.17266313883252601
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.184619011017419
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.21889277727711298
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.16088491956478101
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Fe].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.206594518374744
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.172545200335192
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Fe+2].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.310490454115387
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.195240821405113
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.18788963988163399
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.16174857847841398
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[Na+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.183672161577411
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.159153715401995
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[OH-].[Na+],CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.203281112174861
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.155214547980677
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.166478933922796
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.17596445371945202
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Fe].[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.170627723827936
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.16822743114282002
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Fe+2].[K+].[Na+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.24791173993364599
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.16869642395230902
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.155781345282494
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.190166414989097
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[K+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.17073476360996998
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.194110907409446
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[OH-],CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.19054668708328
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.184617591076552
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.160512061920982
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.17841454074392601
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Fe].[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.210125692391603
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.161610253000598
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Fe+2].[K+].[K+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.238459294972451
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.189777492373928
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.147542828983911
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.15772269907293202
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[Li+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.150096599868865
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.12548632024047898
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Li+].[O-]C(C)(C)C,CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.145730001905339
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.149958234307647
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.135105112975866
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.158497049317143
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Fe].[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.191876292021726
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.14190093366588
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Fe+2].[K+].[Li+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.2220293128787
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.186592232889132
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.175325103107514
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.130749609069623
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=C([O-])O.[K+].[Na+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.184437293775315
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.153224492269451
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Na+].OC([O-])=O,CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.16176789228799598
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.169053716059687
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.160309765354551
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.16077824177926398
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Fe].[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.202142690095793
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.175860434947643
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Fe+2].[K+].[Na+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.261568915740509
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.19803422187793998
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.192939840801785
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.129162828294213
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.146097419549048
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.139718211498022
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,CCN(CC)CC,CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.128303056362919
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.13527643954306
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.143912838388211
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.12678714347748798
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Fe].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.172167948588549
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.143074252820515
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Fe+2].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.23574301886241902
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.177692336632117
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.16813825015168402
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.146828141858498
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Cs+].[F-].[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.167903224406293
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.158278119610477
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[F-].[Cs+],CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.16643643483808201
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.146634168433932
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.138504965422735
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.147761248579395
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Cs+].[F-].[Fe].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.161713038800624
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.15618163536170201
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Cs+].[F-].[Fe+2].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.269657531357785
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.158920685207456
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.14569122343660001
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.137538503353363
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.16467840624234298
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.143529075718945
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.190432706921682
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.144973457703085
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.145000796959666
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.156359449045608
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[Fe].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.185000319314194
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.161674486830495
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[Fe+2].[K+].[K+].[K+].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.24576891228680398
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.177220932854007
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.21895832622993802
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.150003237629478
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.239229838489146
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.164138298409094
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,,C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.187171419979322
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.175938519120973
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.30052319627093804
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.17760046856155098
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Fe].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.223317595901766
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.20276945098794902
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Fe+2].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.334024138500628
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.18688564785488498
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.21147619106683901
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.13235253351861298
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[Na+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.24254761095046798
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.180686800712834
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[OH-].[Na+],C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.23954519890714301
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.174616430517476
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.20275581487508798
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.17392882736549498
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Fe].[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.221959922243815
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.159011170951669
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Fe+2].[K+].[Na+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.216060293779218
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.207909051512092
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.183132931905307
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.15373121255223698
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[K+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.207251250141586
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.16137880338763602
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[OH-],C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.210777858641896
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.163204318122727
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.213664711283516
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.15133274670707
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Fe].[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.216015425123598
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.17402750046029103
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Fe+2].[K+].[K+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.244959760137799
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.18825978315794997
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.17212751209108798
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.147306270993678
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[Li+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.17572260786346
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.152438839430575
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.186506223482094
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.182451991148184
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.17990120700522802
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.159298397408832
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Fe].[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.19713423211275
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.159410393876556
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Fe+2].[K+].[Li+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.197901290675001
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.155677597712784
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.187656527371058
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.153820358281571
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=C([O-])O.[K+].[Na+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.213052621997714
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.149568565267218
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Na+].OC([O-])=O,C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.20821366033309002
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.17069441434461702
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.18002405230576
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.15821531735476
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Fe].[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.236128356286464
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.17562780920136198
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Fe+2].[K+].[Na+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.23144172920112902
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.157894157579019
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.149206875188538
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.131051457049997
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.170972123976396
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.154687223024566
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,CCN(CC)CC,C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.167977535767663
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.15124803317073401
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.236166858242021
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.15907112002114998
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Fe].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.221281993825409
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.187159964347128
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Fe+2].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.267189840998509
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.16818124081074198
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.223273816629032
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.178800456894309
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Cs+].[F-].[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.245450290119482
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.174078827708919
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[F-].[Cs+],C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.22838088457124597
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.16989881760192102
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.272739697875137
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.198110296591984
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Cs+].[F-].[Fe].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.253725299920958
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.235534690171973
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Cs+].[F-].[Fe+2].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.299412556000617
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.196307799314961
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.226442049874895
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.181843943169362
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.254907356037059
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.204860497497955
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.252465029470301
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.200179487369952
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.275170543147037
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.23942960831204002
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[Fe].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.27567535494634
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.232151416622732
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[Fe+2].[K+].[K+].[K+].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.310065968045148
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.20066702995187602
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.184778622027099
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.160725928476393
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.18377976864798998
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.15573229345588602
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,,CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.184753596827961
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.144763534574803
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.18575819770614999
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.153454836016149
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Fe].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.21300295220088303
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.192001952082668
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Fe+2].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.22598029197004302
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.169128578179957
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.17556540699606
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.157202914291868
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[Na+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.226611029800933
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.152974852834486
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[OH-].[Na+],CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.18473867935604002
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.150532562807673
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.172301266478893
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.17260305719503102
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Fe].[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.22501239396075998
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.169367555090247
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Fe+2].[K+].[Na+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.203409556686407
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.180471775974517
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.18636934578750497
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.15779599779263498
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[K+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.188679305004403
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.16461450572433597
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[OH-],CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.184026215734594
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.148722909551475
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.216882540925751
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.152717294745948
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Fe].[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.218719663937311
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.17072042693713002
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Fe+2].[K+].[K+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.211872112941101
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.18258761584768
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.509337025338294
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.164381550615815
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[Li+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.18564665761378202
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.139953547517573
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.20047578869526098
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.162119038508757
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.166663982885376
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.163931778746499
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Fe].[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.21367923921718698
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.160147873377175
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Fe+2].[K+].[Li+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.205203978024226
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.17957569109893298
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.195885908902229
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.16182755651782402
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=C([O-])O.[K+].[Na+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.203544258247649
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.148953411552196
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Na+].OC([O-])=O,CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.169563435574462
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.155781278638681
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.189710429364326
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.171339597937795
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Fe].[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.211267997279706
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.17211609094359498
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Fe+2].[K+].[Na+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.246332353908216
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.211343148460606
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.177736469963938
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.179694922118974
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.18632309700428898
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.172547927305823
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,CCN(CC)CC,CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.156660565784715
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.203272477763266
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.238349693742641
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.205495805648052
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Fe].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.235224258781044
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.217356260112482
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Fe+2].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.34007788825468305
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.18229957183823
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.258321531261809
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.163771258547634
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Cs+].[F-].[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.24483712382733303
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.156547552307526
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[F-].[Cs+],CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.150789546778312
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.175610727550816
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.176336155522544
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.209123802280894
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Cs+].[F-].[Fe].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.298370885541043
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.208273870124278
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Cs+].[F-].[Fe+2].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.35231399367783406
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.180895932638592
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.24531789199989798
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.16588653853216598
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.185757416100608
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.184468064971958
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.198655509604828
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.241886125300639
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.203039697520014
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.19585518535111798
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[Fe].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.21935245529994699
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.179642716858527
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[Fe+2].[K+].[K+].[K+].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.24196041011149
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.16503040160420301
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.17903386394415802
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.208147527802289
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.197519267484284
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.182070358209637
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,,CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.159022946676703
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.16420244071981402
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,,CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.24688034556259597
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.207269500438884
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Fe].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.193211283705197
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.22672005360829398
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Fe+2].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.202803227581135
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.19988537597874198
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.231385457313737
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.249345519017724
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[Na+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.18716179860488802
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.181451192154842
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[OH-].[Na+],CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.19906356951788698
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.183008646618592
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.213923928024353
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.49994714159326004
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Fe].[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.280684398637675
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.48273728327325005
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Fe+2].[K+].[Na+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.246833379291349
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.21676518472199302
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.23564790361378102
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.220987725253555
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[K+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.219469342345694
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.183119463869131
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[OH-],CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.181169726667185
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.17599432122965697
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.220016891725476
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.411946761873601
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Fe].[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.224795236348515
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.470069561627249
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Fe+2].[K+].[K+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.247144824606393
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.187560106682742
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.223147306812057
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.213524682507061
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[Li+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.176311322258592
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.15262297399948
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Li+].[O-]C(C)(C)C,CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.169786867022265
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.151626706688503
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.262377434317628
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.41967098465394004
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Fe].[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.250037034399708
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.590774065713956
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Fe+2].[K+].[Li+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.39337718750502
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.174301383142363
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.210632707305662
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.232332324680959
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=C([O-])O.[K+].[Na+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.21303839215281703
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.147820429806916
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Na+].OC([O-])=O,CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.191024379848062
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.14975182166770298
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.07732238364866731
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.34854643385599204
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Fe].[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.22882822357324098
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.381387889581217
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=C([O-])O.[Fe+2].[K+].[Na+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.225468844955266
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.190397408475386
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.228882543920985
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.189653802216036
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.38794195215181604
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.16735839326703
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,CCN(CC)CC,CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.17015547320681398
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.182739008476155
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.20163663539812302
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.210556483618235
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Fe].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.222128778031019
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.23148996571470298
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Fe+2].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.222710179095998
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.171217266405571
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.22297266921661102
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.21117545745021601
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Cs+].[F-].[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.223059588132792
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.163471198689114
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[F-].[Cs+],CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.197216294400158
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.177674854495982
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.262775099565301
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.199335003352562
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Cs+].[F-].[Fe].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.2095362206191
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.290329135474822
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Cs+].[F-].[Fe+2].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.265032549898113
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.194448620252168
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.220105650045537
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.19819066109967898
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.19284744473859403
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.18143598810842898
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.21388525763169197
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.17831275924437498
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.208862029912608
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.486564394760715
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[Fe].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.21378726286895097
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.434465161484757
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[Fe+2].[K+].[K+].[K+].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.246370699987248
C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.18508735042501
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.405405050475936
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,,CO.O,CC(=O)O~CC(=O)O~[Pd].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5463149460319641
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,,CO.O,CC(=O)O~CC(=O)O~[Pd].CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.46203952432738604
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,,CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.482657181725258
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,,CO.O,CC(=O)O~CC(=O)O~[Pd].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.712281066041578
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,,CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.680859170939943
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,,CO.O,CC(=O)O~CC(=O)O~[Pd].CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.498039141874241
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.459467383597279
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6652065969902811
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],,CO.O,CC(=O)O~CC(=O)O~[Pd].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.440556427835481
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.298390870330192
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,,CO.O,CC(=O)O~CC(=O)O~[Pd].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5429152411989651
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5450722164623459
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Na+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.636951525868476
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.473149248325767
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[OH-].[Na+],CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.50681604713316
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.668697789860257
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.711653340135928
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.482521939276366
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Fe].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.473995521515276
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.548645895107187
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Fe+2].[Na+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.48878446603453396
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.271405798189702
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5123916306873251
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.453511385147187
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[K+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.712547868389221
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.422850091838307
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[OH-],CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.495763451234986
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Cl.O.O.OB(O)c1ccc2ncccc2c1.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8086456762328269
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.797125206708563
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.654437297038207
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Fe].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.297244984135559
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7803892573592079
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Fe+2].[K+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.35523516237654595
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6535530528608839
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC(C)(C)[O-].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.337879429839494
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Li+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Li+].[O-]C(C)(C)C,CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.195069136112674
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.690598882971141
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.833610639865646
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)[O-].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Fe].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.921947956172235
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Fe+2].[Li+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.582147017423796
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=C([O-])O.OB(O)c1ccc2ncccc2c1.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.562038957874574
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=C([O-])O.OB(O)c1ccc2ncccc2c1.[Na+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.505566734457544
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=C([O-])O.OB(O)c1ccc2ncccc2c1.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.405988770363944
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Na+].OC([O-])=O,CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=C([O-])O.OB(O)c1ccc2ncccc2c1.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.415577763479258
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Cl.O.O.O=C([O-])O.OB(O)c1ccc2ncccc2c1.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.669204178444905
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=C([O-])O.OB(O)c1ccc2ncccc2c1.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.665098819019332
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=C([O-])O.OB(O)c1ccc2ncccc2c1.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.23013080293333701
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=C([O-])O.OB(O)c1ccc2ncccc2c1.[Fe].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.313692520934428
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=C([O-])O.OB(O)c1ccc2ncccc2c1.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.362836233855746
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=C([O-])O.OB(O)c1ccc2ncccc2c1.[Fe+2].[Na+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=C([O-])O.OB(O)c1ccc2ncccc2c1.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=C([O-])O.OB(O)c1ccc2ncccc2c1.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.314915345364433
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCN(CC)CC.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.397195880641831
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.422282509284134
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,CCN(CC)CC,CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.37258501525549903
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5883820007211721
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCN(CC)CC.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.567438710464413
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.21710852919339999
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCN(CC)CC.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.350282518698904
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCN(CC)CC.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.268682881495876
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCN(CC)CC.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.270359358475633
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.540154963544849
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Cs+].[F-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.655383489179878
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5454125192616049
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[F-].[Cs+],CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.593684961803891
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.685729186465659
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6971549756702331
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5799041341957359
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Cs+].[F-].[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.596618107817848
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7235724525858571
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Cs+].[F-].[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.43640579184398703
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.28257499244878104
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.498237345298752
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=P([O-])([O-])[O-].OB(O)c1ccc2ncccc2c1.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.40993572773934406
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=P([O-])([O-])[O-].OB(O)c1ccc2ncccc2c1.[K+].[K+].[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.489521516572203
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=P([O-])([O-])[O-].OB(O)c1ccc2ncccc2c1.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.346403163664218
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=P([O-])([O-])[O-].OB(O)c1ccc2ncccc2c1.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.279394495256371
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Cl.O.O.O=P([O-])([O-])[O-].OB(O)c1ccc2ncccc2c1.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.519931110528669
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=P([O-])([O-])[O-].OB(O)c1ccc2ncccc2c1.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.525576921862409
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=P([O-])([O-])[O-].OB(O)c1ccc2ncccc2c1.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=P([O-])([O-])[O-].OB(O)c1ccc2ncccc2c1.[Fe].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.213259505426222
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=P([O-])([O-])[O-].OB(O)c1ccc2ncccc2c1.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.217822498542321
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=P([O-])([O-])[O-].OB(O)c1ccc2ncccc2c1.[Fe+2].[K+].[K+].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=P([O-])([O-])[O-].OB(O)c1ccc2ncccc2c1.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=P([O-])([O-])[O-].OB(O)c1ccc2ncccc2c1.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.225370111703063
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,,CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Na+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.21095199789337
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[OH-].[Na+],CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.188123347795281
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.358026344469478
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.19542814516562299
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Fe].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.350495637172088
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.163529086131536
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Fe+2].[Na+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.199559208809091
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.19704927055948201
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.402439303822655
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[K+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.45856448024225005
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.527013539830445
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[OH-],CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.305005829425026
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Cl.O.O.OB(O)c1ccc2ncccc2c1.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.275584273396117
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.48687178882548304
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.293442456112348
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Fe].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.332252857572933
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.26632960661806204
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Fe+2].[K+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.280775871631717
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.26674657272195
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC(C)(C)[O-].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.540798294610491
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Li+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.467466113247265
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.466488794236493
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Li+].[O-]C(C)(C)C,CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.30638662945371
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.151078423915307
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.429918986626171
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.242700050032468
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)[O-].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Fe].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.257059265500513
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.21361571501051
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Fe+2].[Li+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.194655623209512
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.155756885631068
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=C([O-])O.OB(O)c1ccc2ncccc2c1.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.490130472739151
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=C([O-])O.OB(O)c1ccc2ncccc2c1.[Na+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.38170939192006104
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=C([O-])O.OB(O)c1ccc2ncccc2c1.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.434835476156268
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Na+].OC([O-])=O,CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=C([O-])O.OB(O)c1ccc2ncccc2c1.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.159018074761319
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Cl.O.O.O=C([O-])O.OB(O)c1ccc2ncccc2c1.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.295930085418043
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=C([O-])O.OB(O)c1ccc2ncccc2c1.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.570973494710886
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=C([O-])O.OB(O)c1ccc2ncccc2c1.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.1686914810048
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=C([O-])O.OB(O)c1ccc2ncccc2c1.[Fe].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.19720693014294
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=C([O-])O.OB(O)c1ccc2ncccc2c1.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.17467242196738902
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=C([O-])O.OB(O)c1ccc2ncccc2c1.[Fe+2].[Na+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.384732461473112
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=C([O-])O.OB(O)c1ccc2ncccc2c1.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=C([O-])O.OB(O)c1ccc2ncccc2c1.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.151347296545095
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCN(CC)CC.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.256419385981005
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.276666918662725
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.428689659842538
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,CCN(CC)CC,CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.142101958486669
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.15388124181076798
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCN(CC)CC.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.309689629321045
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCN(CC)CC.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCN(CC)CC.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCN(CC)CC.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.186942520373895
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Cs+].[F-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.23545808860016
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.229783708500715
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[F-].[Cs+],CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.144513791832174
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.21330752281630702
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.42121864213122
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.25447425335261803
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Cs+].[F-].[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.275769217549637
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.234547093505904
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Cs+].[F-].[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.393319974567885
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.24450733125386498
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=P([O-])([O-])[O-].OB(O)c1ccc2ncccc2c1.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.42242935768521905
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=P([O-])([O-])[O-].OB(O)c1ccc2ncccc2c1.[K+].[K+].[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.408863376317639
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=P([O-])([O-])[O-].OB(O)c1ccc2ncccc2c1.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5500581293567479
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=P([O-])([O-])[O-].OB(O)c1ccc2ncccc2c1.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.33999169453097106
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Cl.O.O.O=P([O-])([O-])[O-].OB(O)c1ccc2ncccc2c1.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.33178334039526597
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=P([O-])([O-])[O-].OB(O)c1ccc2ncccc2c1.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.539994377838315
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=P([O-])([O-])[O-].OB(O)c1ccc2ncccc2c1.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.250243202361812
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=P([O-])([O-])[O-].OB(O)c1ccc2ncccc2c1.[Fe].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.298029063352454
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=P([O-])([O-])[O-].OB(O)c1ccc2ncccc2c1.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.284802958866149
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=P([O-])([O-])[O-].OB(O)c1ccc2ncccc2c1.[Fe+2].[K+].[K+].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.44067831183516604
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=P([O-])([O-])[O-].OB(O)c1ccc2ncccc2c1.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=P([O-])([O-])[O-].OB(O)c1ccc2ncccc2c1.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.21140243589312
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.256971960146957
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.257441357934166
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.22590527218498402
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,,C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.18966079390314
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.158627568372741
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.301332294672132
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Na+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.28492346941329
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[OH-].[Na+],C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.21737650098077002
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.276627308063785
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.35759856974084203
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.302432375388826
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Fe].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.412736260055726
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.237224478866646
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Fe+2].[Na+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.19462159963952
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.266172683508653
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[K+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.44950884065936597
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.41868383069824394
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[OH-],C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.309365742941766
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Cl.O.O.OB(O)c1ccc2ncccc2c1.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.389859309997999
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.382013247681786
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Fe].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.499661027735402
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.462116705140599
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Fe+2].[K+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.19271096202789298
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.34998917231395604
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC(C)(C)[O-].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.524719296011214
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Li+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.351034608282083
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.40688623568391596
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.352168500434486
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)[O-].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Fe].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.414185963376097
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Fe+2].[Li+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.237681054107928
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.17978721061585598
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=C([O-])O.OB(O)c1ccc2ncccc2c1.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=C([O-])O.OB(O)c1ccc2ncccc2c1.[Na+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.656934908541084
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=C([O-])O.OB(O)c1ccc2ncccc2c1.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.604993448803632
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Na+].OC([O-])=O,C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=C([O-])O.OB(O)c1ccc2ncccc2c1.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.266631486656218
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Cl.O.O.O=C([O-])O.OB(O)c1ccc2ncccc2c1.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.36922268366495103
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=C([O-])O.OB(O)c1ccc2ncccc2c1.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=C([O-])O.OB(O)c1ccc2ncccc2c1.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.21296669855522102
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=C([O-])O.OB(O)c1ccc2ncccc2c1.[Fe].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.501770683856292
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=C([O-])O.OB(O)c1ccc2ncccc2c1.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.42184108821245403
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=C([O-])O.OB(O)c1ccc2ncccc2c1.[Fe+2].[Na+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.491206490252276
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=C([O-])O.OB(O)c1ccc2ncccc2c1.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=C([O-])O.OB(O)c1ccc2ncccc2c1.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.22930643927546399
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCN(CC)CC.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.38902564358239194
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.357872428090058
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.357353331838505
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,CCN(CC)CC,C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.175647169938363
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCN(CC)CC.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.320524529714214
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.19251614787724003
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCN(CC)CC.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCN(CC)CC.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.246663269236064
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.278663569271257
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCN(CC)CC.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.257135426482769
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Cs+].[F-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.367451692076121
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.445185390058507
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[F-].[Cs+],C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.267863104866736
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.367358407872455
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.286677655448648
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Cs+].[F-].[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.428097016860582
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.152003609862855
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Cs+].[F-].[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.371303584041165
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=P([O-])([O-])[O-].OB(O)c1ccc2ncccc2c1.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.309680268770552
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=P([O-])([O-])[O-].OB(O)c1ccc2ncccc2c1.[K+].[K+].[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.332516832578732
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=P([O-])([O-])[O-].OB(O)c1ccc2ncccc2c1.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.425240403393453
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=P([O-])([O-])[O-].OB(O)c1ccc2ncccc2c1.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.175246577405026
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Cl.O.O.O=P([O-])([O-])[O-].OB(O)c1ccc2ncccc2c1.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.30644780457424803
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=P([O-])([O-])[O-].OB(O)c1ccc2ncccc2c1.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.397255116428075
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=P([O-])([O-])[O-].OB(O)c1ccc2ncccc2c1.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.21774296478233102
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=P([O-])([O-])[O-].OB(O)c1ccc2ncccc2c1.[Fe].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.440041930084065
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=P([O-])([O-])[O-].OB(O)c1ccc2ncccc2c1.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.333251921704611
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=P([O-])([O-])[O-].OB(O)c1ccc2ncccc2c1.[Fe+2].[K+].[K+].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.345062877645475
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=P([O-])([O-])[O-].OB(O)c1ccc2ncccc2c1.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=P([O-])([O-])[O-].OB(O)c1ccc2ncccc2c1.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.191539986468249
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,,CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.19628391295120198
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Na+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.58216798698374
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.321187402290781
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[OH-].[Na+],CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.350234931987856
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.174603760288065
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.40973441669109695
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.39479527463434005
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Fe].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.557469225143572
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.336728203224897
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Fe+2].[Na+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.208610864146939
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.43959882467878997
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[K+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.655847523989013
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.447312707843749
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[OH-],CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.56097220651197
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Cl.O.O.OB(O)c1ccc2ncccc2c1.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.529600788353373
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.569274822043813
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.442519905545838
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Fe].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.718784474728149
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.549519692840107
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Fe+2].[K+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.289365605632373
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC(C)(C)[O-].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.422789620293894
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Li+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6500453684252121
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.368907384314677
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.373748975738136
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.312897083286461
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.456345702377566
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.270443037945477
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)[O-].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Fe].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.64133506684271
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.309714883438018
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Fe+2].[Li+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.153457515363051
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=C([O-])O.OB(O)c1ccc2ncccc2c1.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.233488912851887
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=C([O-])O.OB(O)c1ccc2ncccc2c1.[Na+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.437336946599735
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=C([O-])O.OB(O)c1ccc2ncccc2c1.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.246728173705838
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Na+].OC([O-])=O,CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=C([O-])O.OB(O)c1ccc2ncccc2c1.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.188827174362814
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Cl.O.O.O=C([O-])O.OB(O)c1ccc2ncccc2c1.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.21347053580639097
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=C([O-])O.OB(O)c1ccc2ncccc2c1.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.26689494326964597
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=C([O-])O.OB(O)c1ccc2ncccc2c1.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.275672004474569
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=C([O-])O.OB(O)c1ccc2ncccc2c1.[Fe].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.26278524523915797
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=C([O-])O.OB(O)c1ccc2ncccc2c1.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.21650467872347
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=C([O-])O.OB(O)c1ccc2ncccc2c1.[Fe+2].[Na+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.334609155851335
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=C([O-])O.OB(O)c1ccc2ncccc2c1.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=C([O-])O.OB(O)c1ccc2ncccc2c1.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.186299930968584
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCN(CC)CC.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.236057782794006
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.357227607380553
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.22897677096960098
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,CCN(CC)CC,CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.17237635100333001
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.201595188427504
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCN(CC)CC.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.212779240214026
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCN(CC)CC.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCN(CC)CC.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCN(CC)CC.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Cs+].[F-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.199171987310919
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.28869829577302303
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[F-].[Cs+],CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.18355645838831103
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.451118992997996
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.210665035340973
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Cs+].[F-].[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.39031225448960905
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.162323565923565
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Cs+].[F-].[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.397103322328166
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.158202001792667
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=P([O-])([O-])[O-].OB(O)c1ccc2ncccc2c1.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.28148316268385204
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=P([O-])([O-])[O-].OB(O)c1ccc2ncccc2c1.[K+].[K+].[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.556097730349426
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=P([O-])([O-])[O-].OB(O)c1ccc2ncccc2c1.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.39652531285806397
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=P([O-])([O-])[O-].OB(O)c1ccc2ncccc2c1.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.389182731785928
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Cl.O.O.O=P([O-])([O-])[O-].OB(O)c1ccc2ncccc2c1.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.430505557713552
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=P([O-])([O-])[O-].OB(O)c1ccc2ncccc2c1.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5597452427201159
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=P([O-])([O-])[O-].OB(O)c1ccc2ncccc2c1.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.474590268519888
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=P([O-])([O-])[O-].OB(O)c1ccc2ncccc2c1.[Fe].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.593040767356095
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=P([O-])([O-])[O-].OB(O)c1ccc2ncccc2c1.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.44397155007003003
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=P([O-])([O-])[O-].OB(O)c1ccc2ncccc2c1.[Fe+2].[K+].[K+].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.290156217275374
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=P([O-])([O-])[O-].OB(O)c1ccc2ncccc2c1.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=P([O-])([O-])[O-].OB(O)c1ccc2ncccc2c1.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.436095708900787
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.320836076734582
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,,CO.O,CC(=O)O~CC(=O)O~[Pd].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.361913904734168
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,,CO.O,CC(=O)O~CC(=O)O~[Pd].CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.360678499438707
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,,CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.247278318819857
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,,CO.O,CC(=O)O~CC(=O)O~[Pd].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.441656774760949
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,,CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.395858049713457
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,,CO.O,CC(=O)O~CC(=O)O~[Pd].CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.235972106658604
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Fe].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.22310874112294002
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.241034426275582
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],,CO.O,CC(=O)O~CC(=O)O~[Pd].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Fe+2].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,,CO.O,CC(=O)O~CC(=O)O~[Pd].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.241312940506273
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.597120039972868
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Na+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5799340271320019
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.576937055064357
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[OH-].[Na+],CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.41632023504626803
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7384419996792719
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.602526159862109
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.596328103634999
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Fe].[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.495531461089131
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6778609894050921
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Fe+2].[K+].[Na+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6858072372513879
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.338813881079206
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5093647823129119
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5916085894415599
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[K+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.645917821856057
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.558886751946386
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[OH-],CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.507922188061246
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7235782020429611
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5551268194997551
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.569192968120574
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Fe].[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.556004216959361
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.621390799249698
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Fe+2].[K+].[K+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.512896388650289
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.32323249694379
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.54031851298399
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC(C)(C)[O-].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.262463780929874
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Li+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.705022622417337
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.42714762697603703
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Li+].[O-]C(C)(C)C,CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.428220528994178
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.717092857565289
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.464876388460594
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.54151199939502
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)[O-].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Fe].[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.32064633742568804
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.753138954726551
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Fe+2].[K+].[Li+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.26596402288604504
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.222100733742875
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.529787756301324
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.452370031183737
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=C([O-])O.[K+].[Na+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.648112856537349
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.30560729677424
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Na+].OC([O-])=O,CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.274103749918428
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.627491681635483
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.31171580285282396
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.354340933407361
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=C([O-])O.[Fe].[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.241685685991425
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=C([O-])O.[Fe+2].[K+].[Na+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.323285202769552
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCN(CC)CC.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.500804885380743
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.49101753287127603
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.37795804992790005
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,CCN(CC)CC,CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.297649100573591
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.700685934087637
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCN(CC)CC.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.445535342330147
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.266574935945881
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCN(CC)CC.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Fe].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.287268002224517
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCN(CC)CC.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.364617739024877
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Fe+2].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCN(CC)CC.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.323149999273897
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.41745600902935004
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Cs+].[F-].[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.461211762414897
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.449447629043515
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[F-].[Cs+],CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.285158469100382
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.569164688024597
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.42916545287392505
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.29468400482038404
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Cs+].[F-].[Fe].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.276698023890861
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.309955219813284
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Cs+].[F-].[Fe+2].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.301302306724253
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.558715910994218
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.649770982314504
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.47785624017268397
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.514706207273855
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7121234819725071
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.496659455614965
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.51630151822775
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=P([O-])([O-])[O-].[Fe].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.42843662294817103
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.716712204728133
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=P([O-])([O-])[O-].[Fe+2].[K+].[K+].[K+].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.508408513058598
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.263321784360547
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.54073033421256
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.47915905351615
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.44011224055112697
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.649166424296162
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,,CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.295105149839073
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.405958940198152
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.562854293302899
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.44726924348304103
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Fe].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.38362566402660003
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Fe+2].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.370395253033552
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.238315702046612
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.464826718525274
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Na+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.41949946654543196
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5235494982735429
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[OH-].[Na+],CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.294904148967571
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.45914608866747697
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.592066333688517
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.49139300778538003
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Fe].[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.366081621490316
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.49528378413932006
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Fe+2].[K+].[Na+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.374258783448613
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.571261530487719
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[K+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.471475734744484
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.575158214540996
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[OH-],CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.48360878158904197
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.44717323309589097
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.538449043286596
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Fe].[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.356358973749064
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.512880401731898
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Fe+2].[K+].[K+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.40975333197929104
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC(C)(C)[O-].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.669766759933163
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Li+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.596888669969646
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.625110088484946
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Li+].[O-]C(C)(C)C,CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.593600080452804
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.599363161720667
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6060937503757861
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.623169189690616
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)[O-].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Fe].[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.409634577585403
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.594490457613426
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Fe+2].[K+].[Li+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.38514747025170004
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6683562487285261
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=C([O-])O.[K+].[Na+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.633332718059195
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7199884396037131
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Na+].OC([O-])=O,CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.566573862150855
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5483565066806689
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.648175070839724
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.818166481057112
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=C([O-])O.[Fe].[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.327623597861794
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5205396047393109
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=C([O-])O.[Fe+2].[K+].[Na+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5887295365840469
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCN(CC)CC.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.662857103568699
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.598055915581325
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.696928971502578
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,CCN(CC)CC,CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.44500953516251895
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.48631267423637903
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCN(CC)CC.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.583011095513189
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.523417054330053
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCN(CC)CC.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Fe].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.363539164922321
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCN(CC)CC.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.394873666531023
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Fe+2].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.331344773339763
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCN(CC)CC.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.28583076425557097
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.47747773268652205
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Cs+].[F-].[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.570620592902954
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.633308927929793
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[F-].[Cs+],CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.236111626774262
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.46948147855127403
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6258393949676929
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.46867844019296795
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Cs+].[F-].[Fe].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.406614639593331
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Cs+].[F-].[Fe+2].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.21941247511601802
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5707848345314229
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5583165928421301
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.613206351910101
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.353093997064567
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.467093529068898
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=P([O-])([O-])[O-].[Fe].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=P([O-])([O-])[O-].[Fe+2].[K+].[K+].[K+].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.379586480460289
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.253645588350467
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,,C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.22489552954665298
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.310557218351055
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.531954505975985
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.325901247268989
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Fe].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.40991893051991296
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.269657211156278
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Fe+2].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.30619521546614303
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.21181979179941798
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.29135276464551496
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Na+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.356453169996179
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.415918482266529
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[OH-].[Na+],C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.269356940353174
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.28274451454514
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.394799131708278
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.27913139696793
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Fe].[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.46413326962968704
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Fe+2].[K+].[Na+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.280102716113553
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.288076256742924
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.42233109195929797
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[K+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.393401110032604
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.33064998308048
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[OH-],C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.26714775446079597
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.334095498405342
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.47949316873298303
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.34321208683027005
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Fe].[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.472758398404752
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.319666445944624
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Fe+2].[K+].[K+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.305655218281944
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.28565686601064
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC(C)(C)[O-].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.441337441153065
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Li+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.38912197541654303
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.40143233922641897
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.292426853091284
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.348509282639488
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.388891215380803
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.247311804295758
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)[O-].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Fe].[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.428219234754758
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.29502820801422996
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Fe+2].[K+].[Li+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.23692458366589603
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.519166647506828
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=C([O-])O.[K+].[Na+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.575563303281221
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Na+].OC([O-])=O,C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.420165349363745
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.43120739310055906
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5920229863726361
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.350713567750831
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=C([O-])O.[Fe].[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.535045838122049
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.326397920045409
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=C([O-])O.[Fe+2].[K+].[Na+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.42499512905720105
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.298014983830232
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCN(CC)CC.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.409741198660857
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.461211887118985
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.47231065593792204
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,CCN(CC)CC,C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.252470795056581
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.36313482912197204
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCN(CC)CC.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.526083563735873
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.387773244602065
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCN(CC)CC.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Fe].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.406524899970467
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCN(CC)CC.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.33413938815419003
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Fe+2].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.38699542831397404
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCN(CC)CC.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.20721233537083802
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.33830231608426997
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Cs+].[F-].[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.395625547010457
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.46250723978334896
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[F-].[Cs+],C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.21605915104974202
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.281404463477474
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.45105822072013296
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.33794003853716603
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Cs+].[F-].[Fe].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.411401855150197
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.336049054446635
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Cs+].[F-].[Fe+2].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.345321027224
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.27000423965506803
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.41744936874703903
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.39662357581969
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.30662309778451996
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.385783331989582
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5081882419948299
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.23920158278313297
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=P([O-])([O-])[O-].[Fe].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.43416110329781504
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.37613183414461604
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=P([O-])([O-])[O-].[Fe+2].[K+].[K+].[K+].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.364049032455528
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.199764122584977
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.337890098837487
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.544272475100811
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.493507250916787
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,,CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.292652074150692
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.25052854766698
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.589034115062089
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Fe].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.479751857900665
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Fe+2].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.14266181891264101
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Na+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.254690989856331
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[OH-].[Na+],CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.43825089898727904
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Fe].[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.49886289187077
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Fe+2].[K+].[Na+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[K+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.529371751551838
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[OH-],CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.47429403362406497
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Fe].[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Fe+2].[K+].[K+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.22686721998968998
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC(C)(C)[O-].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.278654430088563
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Li+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.230006247643433
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.18545030867032
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.253658142923221
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.38395981687121794
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.32906204959183805
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)[O-].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Fe].[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.42348145098761103
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9128108189528009
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Fe+2].[K+].[Li+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=C([O-])O.[K+].[Na+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.544816612746565
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Na+].OC([O-])=O,CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=C([O-])O.[Fe].[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=C([O-])O.[Fe+2].[K+].[Na+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCN(CC)CC.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.268584370045693
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.501213576439423
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,CCN(CC)CC,CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.186259604743037
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.415703172510417
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCN(CC)CC.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.331615774149796
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.23133143993501398
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCN(CC)CC.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Fe].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.373640469215065
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCN(CC)CC.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.33271237565705697
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Fe+2].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCN(CC)CC.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.216659412467468
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.297726698952916
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Cs+].[F-].[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[F-].[Cs+],CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.466449168760912
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.49680662591231195
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.382177841343151
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Cs+].[F-].[Fe].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.387101930984327
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Cs+].[F-].[Fe+2].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.610384856603632
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.295277196936559
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.44905653049543
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.539294870729643
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5392221355428449
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=P([O-])([O-])[O-].[Fe].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=P([O-])([O-])[O-].[Fe+2].[K+].[K+].[K+].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.24841274688509
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.183562785267775
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.20639627615027797
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,,CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.185477439406674
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.37074982117600497
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.27141877305540196
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.20487562943268903
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.28877304573494
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Na+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.665279253510639
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.38217746173240896
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[OH-].[Na+],CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.47340240597404604
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.730801554548424
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.40751886891593503
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.539333404757138
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Fe].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.24185975974127
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7118202422603029
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Fe+2].[Na+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.528726284113731
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.236706972930782
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5383148147974081
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.295154080221205
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[K+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7131100989225889
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.231606087025778
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[OH-],CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.45179975925884003
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.759688770685739
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.43330800435008904
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.498770301981968
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Fe].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.267080197652115
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.757715038482424
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Fe+2].[K+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5977643838358371
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5240488899511709
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC(C)(C)[O-].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.274113872369646
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Li+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.771357833590615
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.307161961409996
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Li+].[O-]C(C)(C)C,CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.41504841107864004
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.660488013796859
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.239678541848028
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.48697401478260405
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)[O-].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Fe].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.228094878292688
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Fe+2].[Li+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.449442579986169
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.226416658373551
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.480854136483853
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.315251472071856
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=C([O-])O.[Na+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6167248308928039
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.398203665423228
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Na+].OC([O-])=O,CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.384336426217981
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7794423317190871
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.39307745223816803
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.519693547548403
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=C([O-])O.[Fe].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.270579680868067
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.551541748774632
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=C([O-])O.[Fe+2].[Na+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.232369834744725
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.421427827509586
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CCN(CC)CC.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CCN(CC)CC.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CCN(CC)CC.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,CCN(CC)CC,CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CCN(CC)CC.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.181001747564954
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CCN(CC)CC.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCN(CC)CC.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CCN(CC)CC.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CCN(CC)CC.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CCN(CC)CC.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CCN(CC)CC.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.215019099698158
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCN(CC)CC.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CCN(CC)CC.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.182305711928921
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.201853058088853
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Cs+].[F-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.469379761231237
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.216495291733106
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[F-].[Cs+],CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.11525878211985101
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.605947657939917
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.433371347965603
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.16644325631224302
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Cs+].[F-].[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.11735667274221101
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.23765304847395702
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Cs+].[F-].[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.225403965489951
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.22196273232767802
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[F-].[Cs+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.212771475279255
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.154280250536412
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.754983589633199
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.280642418393694
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.465332439744952
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.762605498964281
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.44446081996417397
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.629823548893002
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=P([O-])([O-])[O-].[Fe].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0918801857462258
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.803991080677073
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=P([O-])([O-])[O-].[Fe+2].[K+].[K+].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.413612704226996
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.225665449126186
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.611506249004639
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.314775204963594
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.20983093706741
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.389034633829692
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,,CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.18646652419381302
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.234325859045804
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.378749206648674
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.227153693692804
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.23020850712346
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.197410079404211
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.195240303334181
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.589575833633508
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Na+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.611408518888483
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.619260442150707
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[OH-].[Na+],CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.357353129695352
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.474068475733949
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.552488098382907
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.601995084354716
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Fe].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.29277270932675
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.545733650401276
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Fe+2].[Na+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.534944815748451
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.790135295458613
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[K+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6505624760980839
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.777768660163031
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[OH-],CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.69461656181469
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.549848519450319
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.517527646321079
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.496922740290008
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Fe].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.3358569157847
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.588105314600502
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Fe+2].[K+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.39217040420037597
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC(C)(C)[O-].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.752707580813476
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Li+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.602767663412792
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.598846832428938
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Li+].[O-]C(C)(C)C,CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.339179800068685
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.463998222835864
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.565148544119644
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5071046648609819
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)[O-].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Fe].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.25783884102520704
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.44715228572802196
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Fe+2].[Li+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.51334598789855
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.882209840463928
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=C([O-])O.[Na+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.751400086893048
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.819438213480984
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Na+].OC([O-])=O,CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6138292019902
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.561186651236832
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.617467073140738
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.484118691779439
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=C([O-])O.[Fe].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.291703087850775
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.546068519663725
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=C([O-])O.[Fe+2].[Na+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.284839340642934
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.406415194894481
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CCN(CC)CC.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.64227244085631
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CCN(CC)CC.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.570635633655689
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CCN(CC)CC.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.70113106485117
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,CCN(CC)CC,CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CCN(CC)CC.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.382055979619143
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CCN(CC)CC.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.45261124624837895
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCN(CC)CC.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.597280220221039
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CCN(CC)CC.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.398725027249995
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CCN(CC)CC.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.20722142655896397
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CCN(CC)CC.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.35988446165376
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CCN(CC)CC.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.279568154671562
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCN(CC)CC.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,CCN(CC)CC,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CCN(CC)CC.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.28370726675672797
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.548281752530539
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Cs+].[F-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.521307659906051
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.624670932186642
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[F-].[Cs+],CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.40561151601283496
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.583640272130923
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.657934483066571
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.584700003325361
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Cs+].[F-].[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.365695082111923
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.689479003409007
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Cs+].[F-].[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.43835018929293
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[F-].[Cs+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.44431300319440703
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8056753054572969
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7057899588443649
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8150854382921651
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.440670274743756
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.678803607765313
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7473281409983581
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.67832553692968
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=P([O-])([O-])[O-].[Fe].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.710490658915541
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=P([O-])([O-])[O-].[Fe+2].[K+].[K+].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.364733396766695
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.521959774520314
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7029575243914191
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.560306908770842
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.504121024624117
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,,C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.378060935832344
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.500439689167549
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5671880938109191
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.35855337370817
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.471289026401478
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.3578830188517
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.277682498149256
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.19124746559645397
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.302546546454029
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6750245880563029
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Na+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.641378120057272
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.479218535921522
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[OH-].[Na+],C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.353959511086483
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6132863436107759
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.560641281595338
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.577806086862015
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Fe].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6017665063246249
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.630817502545375
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Fe+2].[Na+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.54302535968556
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7778500224035589
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[K+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.631860930159467
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.36749320071602903
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[OH-],C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.381033932706236
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.71557088365774
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.538335040106834
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5009731596997731
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Fe].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5793218757906881
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7058607733839
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Fe+2].[K+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.569316978948369
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC(C)(C)[O-].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.70286674828684
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Li+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.683541510299353
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.388028869039984
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.28756321384313
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.626593761992153
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.47867131764680404
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.483344079651511
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)[O-].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Fe].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.43171392187356294
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.58607013357456
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Fe+2].[Li+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.405491871942897
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.773480116259125
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=C([O-])O.[Na+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.791217805116348
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.535328366445931
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Na+].OC([O-])=O,C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5856091950808
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.802718189961346
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7017977489471989
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6505487501581451
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=C([O-])O.[Fe].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.648464359725625
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7114187796057431
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=C([O-])O.[Fe+2].[Na+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.246595013693757
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.424894886973011
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CCN(CC)CC.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.682124419101407
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CCN(CC)CC.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.727188298655934
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CCN(CC)CC.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,CCN(CC)CC,C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CCN(CC)CC.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.401264812291235
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CCN(CC)CC.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.687152945875485
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCN(CC)CC.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.606020077720916
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CCN(CC)CC.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.420199649937649
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CCN(CC)CC.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.483376619280575
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CCN(CC)CC.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.537665846026904
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CCN(CC)CC.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCN(CC)CC.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CCN(CC)CC.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.353163155116507
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.608872116351561
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Cs+].[F-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.598914483664978
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.549114586836727
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[F-].[Cs+],C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.377631671312199
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5234285486383959
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.600642302604528
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.367317689128947
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Cs+].[F-].[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.46505779273936804
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.408554374556183
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Cs+].[F-].[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.334610945229337
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6129863496628211
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.571672162152015
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.511924782569157
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.35388671244193903
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.554814932936932
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5059181319853949
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.459835978967173
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=P([O-])([O-])[O-].[Fe].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.583927858468441
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.495122298999355
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=P([O-])([O-])[O-].[Fe+2].[K+].[K+].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.449185744718561
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.42350156790759
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.464794126473778
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.523317855536389
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,,CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.342913935387131
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.378487475652315
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.510096573047405
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.300377112700302
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.333696816781211
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.29803475437002197
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.342653980231845
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.20967442460293298
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.297552190686288
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Na+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.621855558699314
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.331333206725589
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[OH-].[Na+],CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.332217832555593
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.303300312396963
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.319018551814307
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.33213256822389803
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Fe].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.279678179250988
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.151989665828146
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Fe+2].[Na+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0866784085282458
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0941640641932071
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[K+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.46093189045205496
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.139762663331884
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[OH-],CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.45450506534443597
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.354192775580225
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.248446025807812
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.284319654293046
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Fe].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.274837027343722
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.456730115852093
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Fe+2].[K+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.17116007770744202
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC(C)(C)[O-].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.336896326831097
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Li+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.577836945703638
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.302641448124927
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.485615720445563
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.360276921126573
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)[O-].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Fe].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.299764584600993
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.395768962374163
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Fe+2].[Li+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0917966243292544
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.11355862869702699
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=C([O-])O.[Na+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7728999373615381
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.446362138559576
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Na+].OC([O-])=O,CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.44533591129845296
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.502615146613904
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.356494683657828
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=C([O-])O.[Fe].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.158049638761666
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5615706044680779
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=C([O-])O.[Fe+2].[Na+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[Na+].OC([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.312596177746856
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CCN(CC)CC.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.381468213448889
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CCN(CC)CC.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.518617448707822
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CCN(CC)CC.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.483998129555984
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,CCN(CC)CC,CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CCN(CC)CC.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.467346002887979
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CCN(CC)CC.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.49518861520337304
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCN(CC)CC.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.537410475113383
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CCN(CC)CC.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.38040577362163397
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CCN(CC)CC.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.25787341564137
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CCN(CC)CC.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.44815250995698597
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CCN(CC)CC.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.132571873565445
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCN(CC)CC.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CCN(CC)CC.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.116413562439221
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Cs+].[F-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.598883671659017
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[F-].[Cs+],CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.294859539574103
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.456722474679803
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.31546436144366596
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.356324713972808
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Cs+].[F-].[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0535876926071132
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.484671626104731
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Cs+].[F-].[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.543226468847994
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.298355233115295
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.774676197869978
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5598356678274979
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.51741545478348
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.633827338220575
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.568377819658741
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.697069616473282
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=P([O-])([O-])[O-].[Fe].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.47211430881881694
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=P([O-])([O-])[O-].[Fe+2].[K+].[K+].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.31443681011116
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.541973760523868