Geometry & MOs

Info

ID:	23368
PubChem CID:	603218
Reduced:	BrClN2O3H8C13 (1)
Stoich.:	ABC2D3E8F13 (1)
Weight, g/mol:	353.94068
ΔH_f, kcal/mol:	-3.82
Dipole, Da:	3.0
IP(EA), eV:	-9.6(-1.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-N-(4-chloro-2-nitrophenyl)benzamide

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)Br)C(=O)NC2=C(C=C(C=C2)Cl)[N+](=O)[O-]

DOS

IR

Vibrations