Geometry & MOs

Info

ID:	52173
PubChem CID:	12014972
Reduced:	SO4C9H18 (1)
Stoich.:	AB4C9D18 (1)
Weight, g/mol:	190.102751
ΔH_f, kcal/mol:	-204.17
Dipole, Da:	4.08
IP(EA), eV:	-10.66(0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S,3R,4S)-2-pentylthiolane-3,4-diol

Drug info:

PubChemData

Smile

CCCCC[C@H]1[C@@H]([C@@H](CS1(=O)=O)O)O

DOS

IR

Vibrations