benzene-1,2-diamine; cobalt(2+); 2-methanoylphenolate

Systemtic Name: benzene-1,2-diamine; cobalt(2+); 2-methanoylphenolate Openeye Name: cobaltous; benzene-1,2-diamine; 2-formylphenolate CAS Name: benzene-1,2-diamine; cobalt(2+); 2-formylphenolate IUPAC Name: benzene-1,2-diamine; cobalt(2+); 2-formylphenolate Traditional Name: cobaltous; 2-formylphenolate; o-phenylenediamine Formula: C26H26CoN4O4 MolecularWeight: 517.44224

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/2C7H6O2.2C6H8N2.Co/c2*8-5-6-3-1-2-4-7(6)9;2*7-5-3-1-2-4-6(5)8;/h2*1-5,9H;2*1-4H,7-8H2;/q;;;;+2/p-2