Geometry & MOs

Info

ID:	374116
PubChem CID:	131323874
Reduced:	BrOCl2H9C10 (1)
Stoich.:	ABC2D9E10 (1)
Weight, g/mol:	339.86882
ΔH_f, kcal/mol:	-40.37
Dipole, Da:	0.95
IP(EA), eV:	-9.86(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-bromo-3-[4-bromo-2-(chloromethyl)phenyl]propan-2-one

Drug info:

PubChemData

Smile

C1=CC(=C(C(=C1)CCl)Br)CC(=O)CCl

DOS

IR

Vibrations