Geometry & MOs

Info

ID:

66187

PubChem CID:

46500395

Reduced:

N2O2C19H19 (1)

Stoich.:

A2B2C19D19 (1)

Weight, g/mol:

300.101111

ΔHf, kcal/mol:

50.36

Dipole, Da:

7.55

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 1.247844

Charge, e:

 0

Chem-info

IUPAC name:

(5Z)-5-(quinolin-5-ylhydrazinylidene)quinolin-6-one

Drug info:

PubChemData

Smile

CC1(C2=C(C=CC(=C2)[N+](=O)[O-])[N+](=C1/C=C/C3=CC=CC=C3)C)C

DOS

IR

Vibrations