Geometry & MOs

Info

ID:	5092
PubChem CID:	12576
Reduced:	N2O3H6C7 (1)
Stoich.:	A2B3C6D7 (1)
Weight, g/mol:	166.037842
ΔH_f, kcal/mol:	-22.61
Dipole, Da:	3.21
IP(EA), eV:	-10.9(-1.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-nitrobenzamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations