Geometry & MOs

Info

ID:	372956
PubChem CID:	131307560
Reduced:	BrClN2O3H4C7 (1)
Stoich.:	ABC2D3E4F7 (1)
Weight, g/mol:	277.90938
ΔH_f, kcal/mol:	-22.42
Dipole, Da:	3.82
IP(EA), eV:	-10.42(-1.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-bromo-2-chloro-3-nitrobenzamide

Drug info:

PubChemData

Smile

C1=C(C=C(C(=C1C(=O)N)Cl)[N+](=O)[O-])Br

DOS

IR

Vibrations