nickel(2+); triphenylphosphanium; dithiocyanate

Systemtic Name: nickel(2+); triphenylphosphanium; dithiocyanate Openeye Name: nickelous triphenylphosphonium dithiocyanate CAS Name: nickel(2+); triphenylphosphonium; dithiocyanate IUPAC Name: nickel(2+); triphenylphosphanium; dithiocyanate Traditional Name: nickelous triphenylphosphonium dithiocyanate Formula: C38H32N2NiP2S2+2 MolecularWeight: 701.445002

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[PH+](C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)[PH+](C2=CC=CC=C2)C3=CC=CC=C3.C(#N)[S-].C(#N)[S-].[Ni+2]

Isomeric SMILES

C1=CC=C(C=C1)[PH+](C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)[PH+](C2=CC=CC=C2)C3=CC=CC=C3.C(#N)[S-].C(#N)[S-].[Ni+2]

InChI

InChI=1S/2C18H15P.2CHNS.Ni/c2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;2*2-1-3;/h2*1-15H;2*3H;/q;;;;+2