Geometry & MOs

Info

ID:	432082
PubChem CID:	135172214
Reduced:	SO3C6H10 (1)
Stoich.:	AB3C6D10 (1)
Weight, g/mol:	218.024895
ΔH_f, kcal/mol:	-136.96
Dipole, Da:	3.33
IP(EA), eV:	-9.72(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-methoxycarbonyl-2-oxothiolan-3-yl)acetic acid

Drug info:

PubChemData

Smile

CC1C(CSC(=O)C1O)O

DOS

IR

Vibrations