Geometry & MOs

Info

ID:	213950
PubChem CID:	81065583
Reduced:	N2O4C15H22 (1)
Stoich.:	A2B4C15D22 (1)
Weight, g/mol:	241.131408
ΔH_f, kcal/mol:	-174.04
Dipole, Da:	5.96
IP(EA), eV:	-8.6(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(3,3-dimethyl-2,5-dioxopyrrolidin-1-yl)methyl]pentanoic acid

Drug info:

PubChemData

Smile

CCC(CC(=O)O)CNC(=O)NC1=C(C=CC(=C1)C)OC

DOS

IR

Vibrations