Geometry & MOs

Info

ID:	374581
PubChem CID:	131331769
Reduced:	BrCl2F3H4C8 (1)
Stoich.:	AB2C3D4E8 (1)
Weight, g/mol:	250.89848
ΔH_f, kcal/mol:	-158.31
Dipole, Da:	1.47
IP(EA), eV:	-10.09(-1.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-2-chloro-3-nitrophenol

Drug info:

PubChemData

Smile

C1=C(C=C(C(=C1CCl)Cl)C(F)(F)F)Br

DOS

IR

Vibrations