Geometry & MOs

Info

ID:	146477
PubChem CID:	53696131
Reduced:	NO2C8H9 (1)
Stoich.:	AB2C8D9 (1)
Weight, g/mol:	156.078644
ΔH_f, kcal/mol:	-69.67
Dipole, Da:	4.03
IP(EA), eV:	-9.18(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-hydroxyocta-2,6-dienoic acid

Drug info:

PubChemData

Smile

CC1=CNC(=O)C=C1C(=O)C

DOS

IR

Vibrations