Geometry & MOs

Info

ID:	280986
PubChem CID:	103852319
Reduced:	BrFN3O3H7C12 (1)
Stoich.:	ABC3D3E7F12 (1)
Weight, g/mol:	371.93126
ΔH_f, kcal/mol:	-40.58
Dipole, Da:	9.72
IP(EA), eV:	-10.0(-1.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations