Geometry & MOs

Info

ID:	9449
PubChem CID:	89623
Reduced:	ClOH6C10 (2)
Stoich.:	ABC6D10 (2)
Weight, g/mol:	354.021435
ΔH_f, kcal/mol:	-6.04
Dipole, Da:	0.26
IP(EA), eV:	-10.0(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-(4-chlorobenzoyl)phenyl]-(4-chlorophenyl)methanone

Drug info:

PubChemData

Smile

C1=CC(=CC=C1C(=O)C2=CC=C(C=C2)Cl)C(=O)C3=CC=C(C=C3)Cl

DOS

IR

Vibrations