Geometry & MOs

Info

ID:	266595
PubChem CID:	103574292
Reduced:	FNaSO4C8H8 (1)
Stoich.:	ABCD4E8F8 (1)
Weight, g/mol:	251.985922
ΔH_f, kcal/mol:	-237.94
Dipole, Da:	7.06
IP(EA), eV:	-9.16(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-chloro-6-methoxyphenyl)-hydroxymethanesulfonic acid

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)F)C(O)S(=O)(=O)[O-].[Na+]

DOS

IR

Vibrations