Geometry & MOs

Info

ID:

393781

PubChem CID:

135021679

Reduced:

NOC4H6 (1)

Stoich.:

ABC4D6 (1)

Weight, g/mol:

295.155886

ΔHf, kcal/mol:

19.91

Dipole, Da:

4.05

IP(EA), eV:

0.0(0.0)

Spin(Sz, S2):

0.500000, 0.835234

Charge, e:

-1

Chem-info

IUPAC name:

[[1-(2,6-dimethylphenyl)-2-(N-methylanilino)-2-oxoethyl]hydrazinylidene]azanide

Drug info:

PubChemData

Smile

C(CC=O)C=[N]

DOS

IR

Vibrations