Geometry & MOs

Info

ID:	449519
PubChem CID:	135299234
Reduced:	SO2C5H8 (2)
Stoich.:	AB2C5D8 (2)
Weight, g/mol:	334.108624
ΔH_f, kcal/mol:	-189.07
Dipole, Da:	5.53
IP(EA), eV:	-8.38(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-(6-acetylsulfanylhexanoyloxy)ethoxy]-4-oxobutanoic acid

Drug info:

PubChemData

Smile

C1CSSC1CCCCC(=O)OCC(=O)O

DOS

IR

Vibrations