Geometry & MOs

Info

ID:	288039
PubChem CID:	104309578
Reduced:	ClNO3C10H18 (1)
Stoich.:	ABC3D10E18 (1)
Weight, g/mol:	215.034921
ΔH_f, kcal/mol:	-154.44
Dipole, Da:	7.35
IP(EA), eV:	-9.9(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-3-(4-methyl-2-oxopyridin-1-yl)propanoic acid

Drug info:

PubChemData

Smile

CN(CC1CCOCC1)CC(C(=O)O)Cl

DOS

IR

Vibrations