2-diphenylphosphanylethyl(diphenyl)phosphane; 1-methyl-5-phenyl-3-propan-2-yl-3H-1,4-benzodiazepin-2-one; palladium(2+); dichloride

Systemtic Name: 2-diphenylphosphanylethyl(diphenyl)phosphane; 1-methyl-5-phenyl-3-propan-2-yl-3H-1,4-benzodiazepin-2-one; palladium(2+); dichloride Openeye Name: 2-diphenylphosphanylethyl(diphenyl)phosphane; 3-isopropyl-1-methyl-5-phenyl-3H-1,4-benzodiazepin-2-one; palladium(2+); dichloride CAS Name: 2-diphenylphosphinoethyl(diphenyl)phosphine; 1-methyl-5-phenyl-3-propan-2-yl-3H-1,4-benzodiazepin-2-one; palladium(2+); dichloride IUPAC Name: 2-diphenylphosphanylethyl(diphenyl)phosphane; 1-methyl-5-phenyl-3-propan-2-yl-3H-1,4-benzodiazepin-2-one; palladium(2+); dichloride Traditional Name: 2-diphenylphosphinoethyl(diphenyl)phosphine; 3-isopropyl-1-methyl-5-phenyl-3H-1,4-benzodiazepin-2-one; palladium(2+); dichloride Formula: C64H64Cl2N4O2P2Pd2+2 MolecularWeight: 1266.912082

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1C(=O)N(C2=CC=CC=C2C(=N1)C3=CC=CC=C3)C.CC(C)C1C(=O)N(C2=CC=CC=C2C(=N1)C3=CC=CC=C3)C.C1=CC=C(C=C1)P(CCP(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4.[Cl-].[Cl-].[Pd+2].[Pd+2]

Isomeric SMILES

CC(C)C1C(=O)N(C2=CC=CC=C2C(=N1)C3=CC=CC=C3)C.CC(C)C1C(=O)N(C2=CC=CC=C2C(=N1)C3=CC=CC=C3)C.C1=CC=C(C=C1)P(CCP(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4.[Cl-].[Cl-].[Pd+2].[Pd+2]

InChI

InChI=1S/C26H24P2.2C19H20N2O.2ClH.2Pd/c1-5-13-23(14-6-1)27(24-15-7-2-8-16-24)21-22-28(25-17-9-3-10-18-25)26-19-11-4-12-20-26;2*1-13(2)17-19(22)21(3)16-12-8-7-11-15(16)18(20-17)14-9-5-4-6-10-14;;;;/h1-20H,21-22H2;2*4-13,17H,1-3H3;2*1H;;/q;;;;;2*+2/p-2