Geometry & MOs

Info

ID:	372099
PubChem CID:	131293206
Reduced:	FOBr2H7C9 (1)
Stoich.:	ABC2D7E9 (1)
Weight, g/mol:	309.88272
ΔH_f, kcal/mol:	-61.67
Dipole, Da:	2.24
IP(EA), eV:	-9.98(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-1-(3-bromo-2-fluoro-6-methylphenyl)ethanone

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1Br)F)C(=O)CBr

DOS

IR

Vibrations