Geometry & MOs

Info

ID:	13068
PubChem CID:	220643
Reduced:	ClSO2C8H9 (1)
Stoich.:	ABC2D8E9 (1)
Weight, g/mol:	204.001178
ΔH_f, kcal/mol:	-79.41
Dipole, Da:	5.43
IP(EA), eV:	-9.96(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-chloro-2-methyl-4-methylsulfonylbenzene

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)S(=O)(=O)C)Cl

DOS

IR

Vibrations