Geometry & MOs

Info

ID:	25014
PubChem CID:	616657
Reduced:	OCl2C18H18 (1)
Stoich.:	AB2C18D18 (1)
Weight, g/mol:	320.073471
ΔH_f, kcal/mol:	-30.38
Dipole, Da:	4.75
IP(EA), eV:	-9.34(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,4-bis(4-chlorophenyl)-3,3-dimethylbutan-2-one

Drug info:

PubChemData

Smile

CC(=O)C(C)(C)C(C1=CC=C(C=C1)Cl)C2=CC=C(C=C2)Cl

DOS

IR

Vibrations