Geometry & MOs

Info

ID:	372098
PubChem CID:	131293196
Reduced:	BrClOC8H8 (1)
Stoich.:	ABCD8E8 (1)
Weight, g/mol:	309.88272
ΔH_f, kcal/mol:	-41.57
Dipole, Da:	1.97
IP(EA), eV:	-9.17(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-1-(3-bromo-5-fluoro-2-methylphenyl)ethanone

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1O)Br)CCl

DOS

IR

Vibrations