Geometry & MOs

Info

ID:	408352
PubChem CID:	135081118
Reduced:	NO2C6H11 (1)
Stoich.:	AB2C6D11 (1)
Weight, g/mol:	171.089543
ΔH_f, kcal/mol:	-92.35
Dipole, Da:	5.66
IP(EA), eV:	-9.65(0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E,2R)-2-acetamidohex-4-enoic acid

Drug info:

PubChemData

Smile

CCC/C(=C/C(=O)N)/O

DOS

IR

Vibrations