Geometry & MOs

Info

ID:	18792
PubChem CID:	548322
Reduced:	OSC4H9 (2)
Stoich.:	ABC4D9 (2)
Weight, g/mol:	210.074822
ΔH_f, kcal/mol:	-106.95
Dipole, Da:	4.3
IP(EA), eV:	-8.68(0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-(3-hydroxypropylsulfanyl)ethylsulfanyl]propan-1-ol

Drug info:

PubChemData

Smile

C(CO)CSCCSCCCO

DOS

IR

Vibrations