Geometry & MOs

Info

ID:	62853
PubChem CID:	26737269
Reduced:	ClN2O4C17H19 (1)
Stoich.:	AB2C4D17E19 (1)
Weight, g/mol:	408.064363
ΔH_f, kcal/mol:	-152.13
Dipole, Da:	2.46
IP(EA), eV:	-8.52(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-N-(3-chloro-4-methoxyphenyl)-1-(5-chloro-2-methoxyphenyl)-5-oxopyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations