Geometry & MOs

Info

ID:	9717
PubChem CID:	92567
Reduced:	ClSO3C7H7 (1)
Stoich.:	ABC3D7E7 (1)
Weight, g/mol:	205.980443
ΔH_f, kcal/mol:	-113.05
Dipole, Da:	6.06
IP(EA), eV:	-9.88(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-5-methylbenzenesulfonic acid

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations