3,4-bis(oxidanylidene)cyclobutene-1,2-dithiolate; nickel; 1,10-phenanthroline-1,10-diide

Systemtic Name: 3,4-bis(oxidanylidene)cyclobutene-1,2-dithiolate; nickel; 1,10-phenanthroline-1,10-diide Openeye Name: 3,4-dioxocyclobutene-1,2-dithiolate; nickel; 1,10-phenanthroline-1,10-diide CAS Name: 3,4-dioxocyclobutene-1,2-dithiolate; nickel; 1,10-phenanthroline-1,10-diide IUPAC Name: 3,4-dioxocyclobutene-1,2-dithiolate; nickel; 1,10-phenanthroline-1,10-diide Traditional Name: 3,4-diketocyclobutene-1,2-dithiolate; nickel; 1,10-phenanthroline-1,10-diide Formula: C28H16N4NiO2S2-6 MolecularWeight: 563.27564

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Descriptors Computed from Structure

Canonical SMILES:

C1=C[N-]C2=C3C(=CC=C[N-]3)C=CC2=C1.C1=C[N-]C2=C3C(=CC=C[N-]3)C=CC2=C1.C1(=C(C(=O)C1=O)[S-])[S-].[Ni]

Isomeric SMILES

C1=C[N-]C2=C3C(=CC=C[N-]3)C=CC2=C1.C1=C[N-]C2=C3C(=CC=C[N-]3)C=CC2=C1.C1(=C(C(=O)C1=O)[S-])[S-].[Ni]

InChI

InChI=1S/2C12H8N2.C4H2O2S2.Ni/c2*1-3-9-5-6-10-4-2-8-14-12(10)11(9)13-7-1;5-1-2(6)4(8)3(1)7;/h2*1-8H;7-8H;/q2*-2;;/p-2