Geometry & MOs

Info

ID:	2415
PubChem CID:	7395
Reduced:	ClSO2C7H7 (1)
Stoich.:	ABC2D7E7 (1)
Weight, g/mol:	189.985528
ΔH_f, kcal/mol:	-67.11
Dipole, Da:	4.99
IP(EA), eV:	-10.19(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-chloro-4-methylsulfonylbenzene

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations