azanide; cobalt(2+); 1-[[4-(imidazol-1-ylmethyl)phenyl]methyl]imidazole; dihydrate

Systemtic Name: azanide; cobalt(2+); 1-[[4-(imidazol-1-ylmethyl)phenyl]methyl]imidazole; dihydrate Openeye Name: tricobaltous; azanide; 1-[[4-(imidazol-1-ylmethyl)phenyl]methyl]imidazole; dihydrate CAS Name: azanide; cobalt(2+); 1-[[4-(1-imidazolylmethyl)phenyl]methyl]imidazole; dihydrate IUPAC Name: azanide; cobalt(2+); 1-[[4-(imidazol-1-ylmethyl)phenyl]methyl]imidazole; dihydrate Traditional Name: tricobaltous; azanide; 1-[4-(imidazol-1-ylmethyl)benzyl]imidazole; dihydrate Formula: C28H36Co3N10O2+4 MolecularWeight: 721.45084

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CN2C=CN=C2)CN3C=CN=C3.C1=CC(=CC=C1CN2C=CN=C2)CN3C=CN=C3.[NH2-].[NH2-].O.O.[Co+2].[Co+2].[Co+2]

Isomeric SMILES

C1=CC(=CC=C1CN2C=CN=C2)CN3C=CN=C3.C1=CC(=CC=C1CN2C=CN=C2)CN3C=CN=C3.[NH2-].[NH2-].O.O.[Co+2].[Co+2].[Co+2]

InChI

InChI=1S/2C14H14N4.3Co.2H2N.2H2O/c2*1-2-14(10-18-8-6-16-12-18)4-3-13(1)9-17-7-5-15-11-17;;;;;;;/h2*1-8,11-12H,9-10H2;;;;4*1H2/q;;3*+2;2*-1;;