Geometry & MOs

Info

ID:	372955
PubChem CID:	131307558
Reduced:	BrClN2O3H4C7 (1)
Stoich.:	ABC2D3E4F7 (1)
Weight, g/mol:	277.90938
ΔH_f, kcal/mol:	-21.46
Dipole, Da:	4.06
IP(EA), eV:	-10.62(-1.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-2-chloro-3-nitrobenzamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations