Geometry & MOs

Info

ID:	6327
PubChem CID:	68098
Reduced:	NO4C8H9 (1)
Stoich.:	AB4C8D9 (1)
Weight, g/mol:	183.053158
ΔH_f, kcal/mol:	-161.8
Dipole, Da:	4.83
IP(EA), eV:	-10.92(-1.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(4-methyl-2,5-dioxopyrrol-3-yl)propanoic acid

Drug info:

PubChemData

Smile

CC1=C(C(=O)NC1=O)CCC(=O)O

DOS

IR

Vibrations