Geometry & MOs

Info

ID:	20995
PubChem CID:	586672
Reduced:	ClSO2C9H11 (1)
Stoich.:	ABC2D9E11 (1)
Weight, g/mol:	218.016829
ΔH_f, kcal/mol:	-79.43
Dipole, Da:	3.87
IP(EA), eV:	-9.61(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1-chloro-2-methylsulfonylethyl)benzene

Drug info:

PubChemData

Smile

CS(=O)(=O)CC(C1=CC=CC=C1)Cl

DOS

IR

Vibrations