Geometry & MOs

Info

ID:	289961
PubChem CID:	104391767
Reduced:	ClN2O2C10H19 (1)
Stoich.:	AB2C2D10E19 (1)
Weight, g/mol:	403.0029
ΔH_f, kcal/mol:	-135.35
Dipole, Da:	2.2
IP(EA), eV:	-9.71(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(cyclopropylamino)-1-oxopropan-2-yl]-2-iodo-5-nitrobenzamide

Drug info:

PubChemData

Smile

CC(C)CNC(=O)C(C)NC(=O)C(C)Cl

DOS

IR

Vibrations