Geometry & MOs

Info

ID:	337884
PubChem CID:	127258507
Reduced:	SO3C9H16 (1)
Stoich.:	AB3C9D16 (1)
Weight, g/mol:	268.059172
ΔH_f, kcal/mol:	-158.57
Dipole, Da:	2.01
IP(EA), eV:	-9.46(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(benzenecarbonothioylsulfanyl)ethyl butanoate

Drug info:

PubChemData

Smile

CCCC(=O)OCCC(=O)SCC

DOS

IR

Vibrations