Geometry & MOs

Info

ID:

54501

PubChem CID:

17388784

Reduced:

N2O3C14H14 (1)

Stoich.:

A2B3C14D14 (1)

Weight, g/mol:

301.106256

ΔHf, kcal/mol:

-98.01

Dipole, Da:

4.58

IP(EA), eV:

-9.07(-0.64)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

2-amino-N'-[(1E)-1-(6-methyl-2,4-dioxopyran-3-ylidene)ethyl]benzohydrazide

Drug info:

PubChemData

Smile

CC1=CC(=O)/C(=C(/C)\NC2=CC=CC(=C2)N)/C(=O)O1

DOS

IR

Vibrations