benzene; nickel(2+); 2-[3-[(2-oxidanidyl-3-phenyl-phenyl)methylideneamino]propyliminomethyl]-6-phenyl-phenolate; triphenylphosphane

Systemtic Name: benzene; nickel(2+); 2-[3-[(2-oxidanidyl-3-phenyl-phenyl)methylideneamino]propyliminomethyl]-6-phenyl-phenolate; triphenylphosphane Openeye Name: dinickelous; benzene; 2-[3-[(2-oxido-3-phenyl-phenyl)methyleneamino]propyliminomethyl]-6-phenyl-phenolate; triphenylphosphane CAS Name: benzene; nickel(2+); 2-[3-[(2-oxido-3-phenylphenyl)methylideneamino]propyliminomethyl]-6-phenylphenolate; triphenylphosphine IUPAC Name: benzene; nickel(2+); 2-[3-[(2-oxido-3-phenylphenyl)methylideneamino]propyliminomethyl]-6-phenylphenolate; triphenylphosphane Traditional Name: dinickelous; benzene; 2-[3-[(2-oxido-3-phenyl-benzylidene)amino]propyliminomethyl]-6-phenyl-phenolate; triphenylphosphine Formula: C77H64N2Ni2O2P2 MolecularWeight: 1228.678582

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[C-]C=C1.C1=CC=[C-]C=C1.C1=CC=C(C=C1)C2=C(C(=CC=C2)C=NCCCN=CC3=CC=CC(=C3[O-])C4=CC=CC=C4)[O-].C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.[Ni+2].[Ni+2]

Isomeric SMILES

C1=CC=[C-]C=C1.C1=CC=[C-]C=C1.C1=CC=C(C=C1)C2=C(C(=CC=C2)C=NCCCN=CC3=CC=CC(=C3[O-])C4=CC=CC=C4)[O-].C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.[Ni+2].[Ni+2]

InChI

InChI=1S/C29H26N2O2.2C18H15P.2C6H5.2Ni/c32-28-24(14-7-16-26(28)22-10-3-1-4-11-22)20-30-18-9-19-31-21-25-15-8-17-27(29(25)33)23-12-5-2-6-13-23;2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;2*1-2-4-6-5-3-1;;/h1-8,10-17,20-21,32-33H,9,18-19H2;2*1-15H;2*1-5H;;/q;;;2*-1;2*+2/p-2