Geometry & MOs

Info

ID:	6110
PubChem CID:	67073
Reduced:	N3O4C10H11 (1)
Stoich.:	A3B4C10D11 (1)
Weight, g/mol:	237.074956
ΔH_f, kcal/mol:	-89.5
Dipole, Da:	5.11
IP(EA), eV:	-9.56(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-acetamido-4-nitrophenyl)acetamide

Drug info:

PubChemData

Smile

CC(=O)NC1=CC(=C(C=C1)[N+](=O)[O-])NC(=O)C

DOS

IR

Vibrations