bis(chloranyl)nickel; 2-[3-(naphthalen-1-ylmethyl)-2H-imidazol-1-yl]ethyl-diphenyl-phosphane

Systemtic Name: bis(chloranyl)nickel; 2-[3-(naphthalen-1-ylmethyl)-2H-imidazol-1-yl]ethyl-diphenyl-phosphane Openeye Name: dichloronickel; 2-[3-(1-naphthylmethyl)-2H-imidazol-1-yl]ethyl-diphenyl-phosphane CAS Name: dichloronickel; 2-[3-(1-naphthalenylmethyl)-2H-imidazol-1-yl]ethyl-diphenylphosphine IUPAC Name: dichloronickel; 2-[3-(naphthalen-1-ylmethyl)-2H-imidazol-1-yl]ethyl-diphenylphosphane Traditional Name: dichloronickel; 2-[3-(1-naphthylmethyl)-4-imidazolin-1-yl]ethyl-diphenyl-phosphine Formula: C56H54Cl2N4NiP2 MolecularWeight: 974.601682

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Descriptors Computed from Structure

Canonical SMILES:

C1N(C=CN1CC2=CC=CC3=CC=CC=C32)CCP(C4=CC=CC=C4)C5=CC=CC=C5.C1N(C=CN1CC2=CC=CC3=CC=CC=C32)CCP(C4=CC=CC=C4)C5=CC=CC=C5.Cl[Ni]Cl

Isomeric SMILES

C1N(C=CN1CC2=CC=CC3=CC=CC=C32)CCP(C4=CC=CC=C4)C5=CC=CC=C5.C1N(C=CN1CC2=CC=CC3=CC=CC=C32)CCP(C4=CC=CC=C4)C5=CC=CC=C5.Cl[Ni]Cl

InChI

InChI=1S/2C28H27N2P.2ClH.Ni/c2*1-3-13-26(14-4-1)31(27-15-5-2-6-16-27)21-20-29-18-19-30(23-29)22-25-12-9-11-24-10-7-8-17-28(24)25;;;/h2*1-19H,20-23H2;2*1H;/q;;;;+2/p-2