Geometry & MOs

Info

ID:	179687
PubChem CID:	76519216
Reduced:	SN2O4C8H16 (1)
Stoich.:	AB2C4D8E16 (1)
Weight, g/mol:	345.106851
ΔH_f, kcal/mol:	-131.71
Dipole, Da:	5.8
IP(EA), eV:	-8.23(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5,5-dimethyl-3-(4-methylphenyl)sulfonyl-4-(2-methylpropyl)oxathiazolidine 2-oxide

Drug info:

PubChemData

Smile

CCS(=O)(=O)O.C1CCNC(=CN=O)C1

DOS

IR

Vibrations