bis(2-diphenylphosphaniumylethyl)-phenyl-phosphanium; N-butyl-2,6-dimethyl-aniline; nickel(3+)

Systemtic Name: bis(2-diphenylphosphaniumylethyl)-phenyl-phosphanium; N-butyl-2,6-dimethyl-aniline; nickel(3+) Openeye Name: nickelic; bis(2-diphenylphosphaniumylethyl)-phenyl-phosphonium; N-butyl-2,6-dimethyl-aniline CAS Name: bis(2-diphenylphosphiniumylethyl)-phenylphosphonium; N-butyl-2,6-dimethylaniline; nickel(3+) IUPAC Name: bis(2-diphenylphosphaniumylethyl)-phenylphosphanium; N-butyl-2,6-dimethylaniline; nickel(3+) Traditional Name: nickelic; bis(2-diphenylphosphiniumylethyl)-phenyl-phosphonium; butyl-(2,6-dimethylphenyl)amine Formula: C46H54NNiP3+5 MolecularWeight: 772.542343

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Descriptors Computed from Structure

Canonical SMILES:

CCC[CH-]NC1=C(C=CC=C1C)C.C1=CC=C(C=C1)[PH+](CC[PH+](C2=CC=CC=C2)C3=CC=CC=C3)CC[PH+](C4=CC=CC=C4)C5=CC=CC=C5.[Ni+3]

Isomeric SMILES

CCC[CH-]NC1=C(C=CC=C1C)C.C1=CC=C(C=C1)[PH+](CC[PH+](C2=CC=CC=C2)C3=CC=CC=C3)CC[PH+](C4=CC=CC=C4)C5=CC=CC=C5.[Ni+3]

InChI

InChI=1S/C34H33P3.C12H18N.Ni/c1-6-16-30(17-7-1)35(26-28-36(31-18-8-2-9-19-31)32-20-10-3-11-21-32)27-29-37(33-22-12-4-13-23-33)34-24-14-5-15-25-34;1-4-5-9-13-12-10(2)7-6-8-11(12)3;/h1-25H,26-29H2;6-9,13H,4-5H2,1-3H3;/q;-1;+3/p+3