nickel(2+); (NE,1Z)-N-(1-pyridin-2-ylethylidene)azepane-1-carbohydrazonothioate; thiocyanate

Systemtic Name: nickel(2+); (NE,1Z)-N-(1-pyridin-2-ylethylidene)azepane-1-carbohydrazonothioate; thiocyanate Openeye Name: nickelous (NE,1Z)-N-[1-(2-pyridyl)ethylidene]azepane-1-carbohydrazonothioate thiocyanate CAS Name: nickel(2+); (NE,1Z)-N-[1-(2-pyridinyl)ethylidene]-1-azepanecarbohydrazonothioate; thiocyanate IUPAC Name: nickel(2+); (NE,1Z)-N-(1-pyridin-2-ylethylidene)azepane-1-carbohydrazonothioate; thiocyanate Traditional Name: nickelous (NE,1Z)-N-[1-(2-pyridyl)ethylidene]azepane-1-carbohydrazonothioate thiocyanate Formula: C15H19N5NiS2 MolecularWeight: 392.16826

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NN=C(N1CCCCCC1)[S-])C2=CC=CC=N2.C(#N)[S-].[Ni+2]

Isomeric SMILES

C/C(=N\N=C(\N1CCCCCC1)/[S-])/C2=CC=CC=N2.C(#N)[S-].[Ni+2]

InChI

InChI=1S/C14H20N4S.CHNS.Ni/c1-12(13-8-4-5-9-15-13)16-17-14(19)18-10-6-2-3-7-11-18;2-1-3;/h4-5,8-9H,2-3,6-7,10-11H2,1H3,(H,17,19);3H;/q;;+2/p-2/b16-12+;;