2-cyanoazanidylethanethiolate; gold(1+); triphenylphosphanium

Systemtic Name: 2-cyanoazanidylethanethiolate; gold(1+); triphenylphosphanium Openeye Name: 2-cyanoazanidylethanethiolate; gold(1+); triphenylphosphonium CAS Name: 2-cyanoazanidylethanethiolate; gold(1+); triphenylphosphonium IUPAC Name: 2-cyanoazanidylethanethiolate; gold(1+); triphenylphosphanium Traditional Name: 2-cyanoazanidylethanethiolate; gold(1+); triphenylphosphonium Formula: C39H36Au2N2P2S+2 MolecularWeight: 1020.662162

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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(C[S-])[N-]C#N.[Au+].[Au+]

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(C[S-])[N-]C#N.[Au+].[Au+]

InChI

InChI=1S/2C18H15P.C3H5N2S.2Au/c2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;4-3-5-1-2-6;;/h2*1-15H;6H,1-2H2;;/q;;-1;2*+1/p+1