Geometry & MOs

Info

ID:	11299
PubChem CID:	113449
Reduced:	ClSO3C9H11 (1)
Stoich.:	ABC3D9E11 (1)
Weight, g/mol:	234.011743
ΔH_f, kcal/mol:	-122.74
Dipole, Da:	3.58
IP(EA), eV:	-9.98(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloroethyl 2-methylbenzenesulfonate

Drug info:

PubChemData

Smile

CC1=CC=CC=C1S(=O)(=O)OCCCl

DOS

IR

Vibrations