Geometry & MOs

Info

ID:	56530
PubChem CID:	17436131
Reduced:	N2O4H14C15 (1)
Stoich.:	A2B4C14D15 (1)
Weight, g/mol:	393.028311
ΔH_f, kcal/mol:	-44.46
Dipole, Da:	4.95
IP(EA), eV:	-9.07(-1.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-N-[3-chloro-4-(2-oxopyrrolidin-1-yl)phenyl]-3-nitrobenzamide

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)NC(=O)C2=CC(=CC(=C2)OC)[N+](=O)[O-]

DOS

IR

Vibrations