Geometry & MOs

Info

ID:	6863
PubChem CID:	70298
Reduced:	OCl2H6C8 (1)
Stoich.:	AB2C6D8 (1)
Weight, g/mol:	187.97957
ΔH_f, kcal/mol:	-29.3
Dipole, Da:	2.29
IP(EA), eV:	-10.04(-1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-1-(4-chlorophenyl)ethanone

Drug info:

PubChemData

Smile

C1=CC(=CC=C1C(=O)CCl)Cl

DOS

IR

Vibrations