copper; [2-(2-diphenylphosphanylphenoxy)phenyl]-diphenyl-phosphane; 2-pyridin-2-yl-1H-benzimidazole

Systemtic Name: copper; [2-(2-diphenylphosphanylphenoxy)phenyl]-diphenyl-phosphane; 2-pyridin-2-yl-1H-benzimidazole Openeye Name: copper; [2-(2-diphenylphosphanylphenoxy)phenyl]-diphenyl-phosphane; 2-(2-pyridyl)-1H-benzimidazole CAS Name: copper; [2-(2-diphenylphosphinophenoxy)phenyl]-diphenylphosphine; 2-(2-pyridinyl)-1H-benzimidazole IUPAC Name: copper; [2-(2-diphenylphosphanylphenoxy)phenyl]-diphenylphosphane; 2-pyridin-2-yl-1H-benzimidazole Traditional Name: cupric; [2-(2-diphenylphosphinophenoxy)phenyl]-diphenyl-phosphine; 2-(2-pyridyl)-1H-benzimidazole Formula: C48H37CuN3OP2+2 MolecularWeight: 797.320402

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3OC4=CC=CC=C4P(C5=CC=CC=C5)C6=CC=CC=C6.C1=CC=C2C(=C1)NC(=N2)C3=CC=CC=N3.[Cu+2]

Isomeric SMILES

C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3OC4=CC=CC=C4P(C5=CC=CC=C5)C6=CC=CC=C6.C1=CC=C2C(=C1)NC(=N2)C3=CC=CC=N3.[Cu+2]

InChI

InChI=1S/C36H28OP2.C12H9N3.Cu/c1-5-17-29(18-6-1)38(30-19-7-2-8-20-30)35-27-15-13-25-33(35)37-34-26-14-16-28-36(34)39(31-21-9-3-10-22-31)32-23-11-4-12-24-32;1-2-6-10-9(5-1)14-12(15-10)11-7-3-4-8-13-11;/h1-28H;1-8H,(H,14,15);/q;;+2