Geometry & MOs

Info

ID:	59606
PubChem CID:	24883437
Reduced:	H2O2S3 (1)
Stoich.:	A2B2C3 (1)
Weight, g/mol:	342.140199
ΔH_f, kcal/mol:	-74.35
Dipole, Da:	2.14
IP(EA), eV:	-10.09(-2.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-N-ethyl-3-(4-ethylphenyl)-2-[3-(hydroxymethyl)pyridin-1-ium-1-yl]-3-oxopropanimidothioate

Drug info:

PubChemData

Smile

OS(=O)(=S)S

DOS

IR

Vibrations