Geometry & MOs

Info

ID:	198961
PubChem CID:	79178934
Reduced:	N2O3C16H22 (1)
Stoich.:	A2B3C16D22 (1)
Weight, g/mol:	291.110673
ΔH_f, kcal/mol:	-119.48
Dipole, Da:	3.5
IP(EA), eV:	-8.67(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-(3,4-dimethyl-2,5-dioxopyrrolidin-1-yl)ethoxy]benzoic acid

Drug info:

PubChemData

Smile

CC1C(C(=O)N(C1=O)CCOC2=CC=C(C=C2)CCN)C

DOS

IR

Vibrations