Geometry & MOs

Info

ID:

177268

PubChem CID:

76157631

Reduced:

ClCuN4O4C15H27 (1)

Stoich.:

ABC4D4E15F27 (1)

Weight, g/mol:

324.05964

ΔHf, kcal/mol:

11.39

Dipole, Da:

15.12

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 1.784760

Charge, e:

 1

Chem-info

IUPAC name:

sodium;3-[(4-methyl-2-nitrophenyl)hydrazinylidene]-6-oxocyclohexa-1,4-diene-1-carboxylic acid

Drug info:

PubChemData

Smile

C1CC[N-]C(C1)C=NCCCN=CC2CCCC[N-]2.OCl(=O)(=O)=O.[Cu+2]

DOS

IR

Vibrations