bis(2-diphenylphosphanylphenyl)-phenyl-phosphane; 1,3-dibutyl-5-(1,3-dibutyl-5-sulfanidyl-2-sulfanylidene-imidazol-4-yl)-2-sulfanylidene-imidazole-4-thiolate; nickel(2+)

Systemtic Name: bis(2-diphenylphosphanylphenyl)-phenyl-phosphane; 1,3-dibutyl-5-(1,3-dibutyl-5-sulfanidyl-2-sulfanylidene-imidazol-4-yl)-2-sulfanylidene-imidazole-4-thiolate; nickel(2+) Openeye Name: nickelous; bis(2-diphenylphosphanylphenyl)-phenyl-phosphane; 1,3-dibutyl-5-(1,3-dibutyl-5-sulfido-2-thioxo-imidazol-4-yl)-2-thioxo-imidazole-4-thiolate CAS Name: bis(2-diphenylphosphinophenyl)-phenylphosphine; 1,3-dibutyl-5-(1,3-dibutyl-2-sulfanylidene-5-sulfido-4-imidazolyl)-2-sulfanylidene-4-imidazolethiolate; nickel(2+) IUPAC Name: bis(2-diphenylphosphanylphenyl)-phenylphosphane; 1,3-dibutyl-5-(1,3-dibutyl-2-sulfanylidene-5-sulfidoimidazol-4-yl)-2-sulfanylideneimidazole-4-thiolate; nickel(2+) Traditional Name: nickelous; bis(2-diphenylphosphinophenyl)-phenyl-phosphine; 1,3-dibutyl-5-(1,3-dibutyl-5-sulfido-2-thioxo-4-imidazolin-4-yl)-2-thioxo-4-imidazoline-4-thiolate Formula: C64H69N4NiP3S4 MolecularWeight: 1174.134143

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(N(C1=S)CCCC)[S-])C2=C(N(C(=S)N2CCCC)CCCC)[S-].C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3P(C4=CC=CC=C4)C5=CC=CC=C5P(C6=CC=CC=C6)C7=CC=CC=C7.[Ni+2]

Isomeric SMILES

CCCCN1C(=C(N(C1=S)CCCC)[S-])C2=C(N(C(=S)N2CCCC)CCCC)[S-].C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3P(C4=CC=CC=C4)C5=CC=CC=C5P(C6=CC=CC=C6)C7=CC=CC=C7.[Ni+2]

InChI

InChI=1S/C42H33P3.C22H38N4S4.Ni/c1-6-20-34(21-7-1)43(35-22-8-2-9-23-35)39-30-16-18-32-41(39)45(38-28-14-5-15-29-38)42-33-19-17-31-40(42)44(36-24-10-3-11-25-36)37-26-12-4-13-27-37;1-5-9-13-23-17(19(27)25(21(23)29)15-11-7-3)18-20(28)26(16-12-8-4)22(30)24(18)14-10-6-2;/h1-33H;27-28H,5-16H2,1-4H3;/q;;+2/p-2