Geometry & MOs

Info

ID:	202528
PubChem CID:	79682759
Reduced:	SF3O3C11H13 (1)
Stoich.:	AB3C3D11E13 (1)
Weight, g/mol:	297.070465
ΔH_f, kcal/mol:	-281.53
Dipole, Da:	3.07
IP(EA), eV:	-9.28(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,3-dihydroxypropylsulfanyl)-N-(1,1-dioxothiolan-3-yl)-N-methylacetamide

Drug info:

PubChemData

Smile

C1=CC(=CC=C1CSCC(CO)O)OC(F)(F)F

DOS

IR

Vibrations