cobalt(2+); 1-(6-ethanoylpyridin-2-yl)ethanone; 2,4,6-trimethylcyclohexa-2,4-dien-1-imine

Systemtic Name: cobalt(2+); 1-(6-ethanoylpyridin-2-yl)ethanone; 2,4,6-trimethylcyclohexa-2,4-dien-1-imine Openeye Name: cobaltous; 1-(6-acetyl-2-pyridyl)ethanone; 2,4,6-trimethylcyclohexa-2,4-dien-1-imine CAS Name: 1-(6-acetyl-2-pyridinyl)ethanone; cobalt(2+); 2,4,6-trimethyl-1-cyclohexa-2,4-dienimine IUPAC Name: 1-(6-acetylpyridin-2-yl)ethanone; cobalt(2+); 2,4,6-trimethylcyclohexa-2,4-dien-1-imine Traditional Name: cobaltous; 1-(6-acetyl-2-pyridyl)ethanone; (2,4,6-trimethylcyclohexa-2,4-dien-1-ylidene)amine Formula: C27H35CoN3O2+2 MolecularWeight: 492.5189

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C=C(C=C(C1=N)C)C.CC1C=C(C=C(C1=N)C)C.CC(=O)C1=NC(=CC=C1)C(=O)C.[Co+2]

Isomeric SMILES

CC1C=C(C=C(C1=N)C)C.CC1C=C(C=C(C1=N)C)C.CC(=O)C1=NC(=CC=C1)C(=O)C.[Co+2]

InChI

InChI=1S/C9H9NO2.2C9H13N.Co/c1-6(11)8-4-3-5-9(10-8)7(2)12;2*1-6-4-7(2)9(10)8(3)5-6;/h3-5H,1-2H3;2*4-5,7,10H,1-3H3;/q;;;+2