Geometry & MOs

Info

ID:	1461
PubChem CID:	4511
Reduced:	N3H5O5C7 (1)
Stoich.:	A3B5C5D7 (1)
Weight, g/mol:	211.02292
ΔH_f, kcal/mol:	-22.09
Dipole, Da:	4.67
IP(EA), eV:	-11.34(-2.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,5-dinitrobenzamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations