Geometry & MOs

Info

ID:	154385
PubChem CID:	56313808
Reduced:	SN2O3C21H28 (1)
Stoich.:	AB2C3D21E28 (1)
Weight, g/mol:	370.144806
ΔH_f, kcal/mol:	-105.42
Dipole, Da:	7.6
IP(EA), eV:	-9.78(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-2-(2-oxopyrrolidin-1-yl)-N-(3-phenylbutyl)benzamide

Drug info:

PubChemData

Smile

CCC(C)NS(=O)(=O)C1=CC=C(C=C1)C(=O)NCCC(C)C2=CC=CC=C2

DOS

IR

Vibrations