Geometry & MOs

Info

ID:	266596
PubChem CID:	103574339
Reduced:	ClSO5C8H9 (1)
Stoich.:	ABC5D8E9 (1)
Weight, g/mol:	261.94788
ΔH_f, kcal/mol:	-189.09
Dipole, Da:	7.25
IP(EA), eV:	-9.6(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

sodium;(4-chloro-2-fluorophenyl)-hydroxymethanesulfonate

Drug info:

PubChemData

Smile

COC1=C(C(=CC=C1)Cl)C(O)S(=O)(=O)O

DOS

IR

Vibrations