Geometry & MOs

Info

ID:

1273

PubChem CID:

4077

Reduced:

C2S2O3H5 (1)

Stoich.:

A2B2C3D5 (1)

Weight, g/mol:

140.968011

ΔHf, kcal/mol:

-73.8

Dipole, Da:

1.07

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 0.759496

Charge, e:

 -1

Chem-info

IUPAC name:

2-sulfanylethanesulfonate

Drug info:

PubChemData

Smile

C(CS(=O)(=O)[O-])S

DOS

IR

Vibrations