1,2-diphenyl-2-sulfanylidene-ethanethiolate; nickel(2+)

Systemtic Name: 1,2-diphenyl-2-sulfanylidene-ethanethiolate; nickel(2+) Openeye Name: nickelous 1,2-diphenyl-2-thioxo-ethanethiolate CAS Name: 1,2-diphenyl-2-sulfanylideneethanethiolate; nickel(2+) IUPAC Name: 1,2-diphenyl-2-sulfanylideneethanethiolate; nickel(2+) Traditional Name: nickelous 1,2-diphenyl-2-thioxo-ethanethiolate Formula: C28H22NiS4 MolecularWeight: 545.42768

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(=S)C2=CC=CC=C2)[S-].C1=CC=C(C=C1)C(C(=S)C2=CC=CC=C2)[S-].[Ni+2]

Isomeric SMILES

C1=CC=C(C=C1)C(C(=S)C2=CC=CC=C2)[S-].C1=CC=C(C=C1)C(C(=S)C2=CC=CC=C2)[S-].[Ni+2]

InChI

InChI=1S/2C14H12S2.Ni/c2*15-13(11-7-3-1-4-8-11)14(16)12-9-5-2-6-10-12;/h2*1-10,13,15H;/q;;+2/p-2