Geometry & MOs

Info

ID:	266597
PubChem CID:	103574340
Reduced:	ClFNaSO4H5C7 (1)
Stoich.:	ABCDE4F5G7 (1)
Weight, g/mol:	307.87886
ΔH_f, kcal/mol:	-253.8
Dipole, Da:	7.87
IP(EA), eV:	-9.58(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

sodium;(4-bromo-5-methylthiophen-2-yl)-hydroxymethanesulfonate

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1Cl)F)C(O)S(=O)(=O)[O-].[Na+]

DOS

IR

Vibrations