N,N-dimethylmethanamide; nickel(2+); 2-[3-(2-sulfanidylphenyl)-2H-imidazol-1-yl]benzenethiolate

Systemtic Name: N,N-dimethylmethanamide; nickel(2+); 2-[3-(2-sulfanidylphenyl)-2H-imidazol-1-yl]benzenethiolate Openeye Name: dinickelous; N,N-dimethylformamide; 2-[3-(2-sulfidophenyl)-2H-imidazol-1-yl]benzenethiolate CAS Name: N,N-dimethylformamide; nickel(2+); 2-[3-(2-sulfidophenyl)-2H-imidazol-1-yl]benzenethiolate IUPAC Name: N,N-dimethylformamide; nickel(2+); 2-[3-(2-sulfidophenyl)-2H-imidazol-1-yl]benzenethiolate Traditional Name: dinickelous; N,N-dimethylformamide; 2-[3-(2-sulfidophenyl)-4-imidazolin-1-yl]benzenethiolate Formula: C33H31N5Ni2OS4 MolecularWeight: 759.27894

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C=O.C1N(C=CN1C2=CC=CC=C2[S-])C3=CC=CC=C3[S-].C1N(C=CN1C2=CC=CC=C2[S-])C3=CC=CC=C3[S-].[Ni+2].[Ni+2]

Isomeric SMILES

CN(C)C=O.C1N(C=CN1C2=CC=CC=C2[S-])C3=CC=CC=C3[S-].C1N(C=CN1C2=CC=CC=C2[S-])C3=CC=CC=C3[S-].[Ni+2].[Ni+2]

InChI

InChI=1S/2C15H14N2S2.C3H7NO.2Ni/c2*18-14-7-3-1-5-12(14)16-9-10-17(11-16)13-6-2-4-8-15(13)19;1-4(2)3-5;;/h2*1-10,18-19H,11H2;3H,1-2H3;;/q;;;2*+2/p-4