Geometry & MOs

Info

ID:	4819
PubChem CID:	12091
Reduced:	N2O3H6C7 (1)
Stoich.:	A2B3C6D7 (1)
Weight, g/mol:	166.037842
ΔH_f, kcal/mol:	-21.88
Dipole, Da:	4.82
IP(EA), eV:	-10.91(-1.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-nitrobenzamide

Drug info:

PubChemData

Smile

C1=CC(=CC=C1C(=O)N)[N+](=O)[O-]

DOS

IR

Vibrations