Geometry & MOs

Info

ID:	229777
PubChem CID:	87568950
Reduced:	SF3O3H5C7 (1)
Stoich.:	AB3C3D5E7 (1)
Weight, g/mol:	264.048132
ΔH_f, kcal/mol:	-232.88
Dipole, Da:	3.06
IP(EA), eV:	-9.68(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-carboxybutanoyloxy)-3-hydroxybutanedioic acid

Drug info:

PubChemData

Smile

CS(=O)(=O)OC1=C(C=CC(=C1F)F)F

DOS

IR

Vibrations