(dipropylamino)methanedithiolate; nickel(3+); triphenylphosphanium

Systemtic Name: (dipropylamino)methanedithiolate; nickel(3+); triphenylphosphanium Openeye Name: nickelic; (dipropylamino)methanedithiolate; triphenylphosphonium CAS Name: (dipropylamino)methanedithiolate; nickel(3+); triphenylphosphonium IUPAC Name: (dipropylamino)methanedithiolate; nickel(3+); triphenylphosphanium Traditional Name: nickelic; (dipropylamino)methanedithiolate; triphenylphosphonium Formula: C43H47NNiP2S2+3 MolecularWeight: 762.610902

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)C([S-])[S-].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.[Ni+3]

Isomeric SMILES

CCCN(CCC)C([S-])[S-].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.[Ni+3]

InChI

InChI=1S/2C18H15P.C7H17NS2.Ni/c2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-3-5-8(6-4-2)7(9)10;/h2*1-15H;7,9-10H,3-6H2,1-2H3;/q;;;+3