Geometry & MOs

Info

ID:	205582
PubChem CID:	80123691
Reduced:	SO2C18H20 (1)
Stoich.:	AB2C18D20 (1)
Weight, g/mol:	340.03585
ΔH_f, kcal/mol:	-40.59
Dipole, Da:	3.76
IP(EA), eV:	-8.44(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-chlorothiophen-2-yl)-2-[(3,5-dimethylphenyl)methylsulfinyl]propan-1-one

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1)CS(=O)C(C)C(=O)C2=CC=CC=C2)C

DOS

IR

Vibrations