Geometry & MOs

Info

ID:	12549
PubChem CID:	140220
Reduced:	ClN2O3H7C8 (1)
Stoich.:	AB2C3D7E8 (1)
Weight, g/mol:	214.01452
ΔH_f, kcal/mol:	-36.1
Dipole, Da:	7.2
IP(EA), eV:	-9.92(-1.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-N-(4-nitrophenyl)acetamide

Drug info:

PubChemData

Smile

C1=CC(=CC=C1NC(=O)CCl)[N+](=O)[O-]

DOS

IR

Vibrations