Geometry & MOs

Info

ID:	11291
PubChem CID:	113334
Reduced:	OCl2C10H10 (1)
Stoich.:	AB2C10D10 (1)
Weight, g/mol:	216.01087
ΔH_f, kcal/mol:	-46.9
Dipole, Da:	4.56
IP(EA), eV:	-9.69(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-chloro-1-(2-chloro-5-methylphenyl)propan-1-one

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)Cl)C(=O)CCCl

DOS

IR

Vibrations