nickel(2+); tetrabutylazanium; 2,5,6-tris(chloranyl)pyridine-3,4-dithiolate

Systemtic Name: nickel(2+); tetrabutylazanium; 2,5,6-tris(chloranyl)pyridine-3,4-dithiolate Openeye Name: nickelous; tetrabutylammonium; 2,5,6-trichloropyridine-3,4-dithiolate CAS Name: nickel(2+); tetrabutylammonium; 2,5,6-trichloropyridine-3,4-dithiolate IUPAC Name: nickel(2+); tetrabutylazanium; 2,5,6-trichloropyridine-3,4-dithiolate Traditional Name: nickelous; tetrabutylammonium; 2,5,6-trichloropyridine-3,4-dithiolate Formula: C74H144Cl6N6NiS4+2 MolecularWeight: 1517.64676

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+](CCCC)(CCCC)CCCC.CCCC[N+](CCCC)(CCCC)CCCC.CCCC[N+](CCCC)(CCCC)CCCC.CCCC[N+](CCCC)(CCCC)CCCC.C1(=C(C(=NC(=C1Cl)Cl)Cl)[S-])[S-].C1(=C(C(=NC(=C1Cl)Cl)Cl)[S-])[S-].[Ni+2]

Isomeric SMILES

CCCC[N+](CCCC)(CCCC)CCCC.CCCC[N+](CCCC)(CCCC)CCCC.CCCC[N+](CCCC)(CCCC)CCCC.CCCC[N+](CCCC)(CCCC)CCCC.C1(=C(C(=NC(=C1Cl)Cl)Cl)[S-])[S-].C1(=C(C(=NC(=C1Cl)Cl)Cl)[S-])[S-].[Ni+2]

InChI

InChI=1S/4C16H36N.2C5H2Cl3NS2.Ni/c4*1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;2*6-1-2(10)3(11)5(8)9-4(1)7;/h4*5-16H2,1-4H3;2*11H,(H,9,10);/q4*+1;;;+2/p-4