Geometry & MOs

Info

ID:	398305
PubChem CID:	135032743
Reduced:	ClNSO4C16H16 (1)
Stoich.:	ABCD4E16F16 (1)
Weight, g/mol:	423.976926
ΔH_f, kcal/mol:	-65.68
Dipole, Da:	2.44
IP(EA), eV:	-9.44(-2.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,3-bis(2,4-dichlorophenyl)-1-phenylpropan-1-one

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C(C)(CS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])Cl

DOS

IR

Vibrations