nickel; 4-pentan-3-ylpiperidin-1-ide; 4-pentan-3-yl-2H-pyridin-1-ide; dithiocyanate

Systemtic Name: nickel; 4-pentan-3-ylpiperidin-1-ide; 4-pentan-3-yl-2H-pyridin-1-ide; dithiocyanate Openeye Name: 4-(1-ethylpropyl)piperidin-1-ide; 4-(1-ethylpropyl)-2H-pyridin-1-ide; nickel; dithiocyanate CAS Name: nickel; 4-pentan-3-ylpiperidin-1-ide; 4-pentan-3-yl-2H-pyridin-1-ide; dithiocyanate IUPAC Name: nickel; 4-pentan-3-ylpiperidin-1-ide; 4-pentan-3-yl-2H-pyridin-1-ide; dithiocyanate Traditional Name: 4-(1-ethylpropyl)piperidin-1-ide; 4-(1-ethylpropyl)-2H-pyridin-1-ide; nickel; dithiocyanate Formula: C42H76N6NiS2-6 MolecularWeight: 787.91644

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C1CC[N-]CC1.CCC(CC)C1CC[N-]CC1.CCC(CC)C1CC[N-]CC1.CCC(CC)C1=CC[N-]C=C1.C(#N)[S-].C(#N)[S-].[Ni]

Isomeric SMILES

CCC(CC)C1CC[N-]CC1.CCC(CC)C1CC[N-]CC1.CCC(CC)C1CC[N-]CC1.CCC(CC)C1=CC[N-]C=C1.C(#N)[S-].C(#N)[S-].[Ni]

InChI

InChI=1S/3C10H20N.C10H16N.2CHNS.Ni/c4*1-3-9(4-2)10-5-7-11-8-6-10;2*2-1-3;/h3*9-10H,3-8H2,1-2H3;5-7,9H,3-4,8H2,1-2H3;2*3H;/q4*-1;;;/p-2