Geometry & MOs

Info

ID:	62448
PubChem CID:	26719730
Reduced:	ClN2O3C16H17 (1)
Stoich.:	AB2C3D16E17 (1)
Weight, g/mol:	348.043233
ΔH_f, kcal/mol:	-116.77
Dipole, Da:	3.62
IP(EA), eV:	-9.08(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-1-(2-chlorophenyl)-N-(3-chlorophenyl)-5-oxopyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

CCC1=C(C(=C(N1)C(=O)NC2=CC(=CC=C2)Cl)C)C(=O)OC

DOS

IR

Vibrations