cobalt(2+); 2,6-dimethyl-1-oxidanyl-pyridin-1-ium; diisothiocyanate

Systemtic Name: cobalt(2+); 2,6-dimethyl-1-oxidanyl-pyridin-1-ium; diisothiocyanate Openeye Name: cobaltous 1-hydroxy-2,6-dimethyl-pyridin-1-ium diisothiocyanate CAS Name: cobalt(2+); 1-hydroxy-2,6-dimethylpyridin-1-ium; diisothiocyanate IUPAC Name: cobalt(2+); 1-hydroxy-2,6-dimethylpyridin-1-ium; diisothiocyanate Traditional Name: cobaltous 1-hydroxy-2,6-dimethyl-pyridin-1-ium diisothiocyanate Formula: C16H20CoN4O2S2+2 MolecularWeight: 423.4188

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C(=CC=C1)C)O.CC1=[N+](C(=CC=C1)C)O.C(=[N-])=S.C(=[N-])=S.[Co+2]

Isomeric SMILES

CC1=[N+](C(=CC=C1)C)O.CC1=[N+](C(=CC=C1)C)O.C(=[N-])=S.C(=[N-])=S.[Co+2]

InChI

InChI=1S/2C7H10NO.2CNS.Co/c2*1-6-4-3-5-7(2)8(6)9;2*2-1-3;/h2*3-5,9H,1-2H3;;;/q2*+1;2*-1;+2