Geometry & MOs

Info

ID:	260110
PubChem CID:	103181541
Reduced:	SO3C8H18 (1)
Stoich.:	AB3C8D18 (1)
Weight, g/mol:	222.128966
ΔH_f, kcal/mol:	-142.45
Dipole, Da:	3.03
IP(EA), eV:	-8.93(0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-(3-methoxypropoxy)ethylsulfanyl]butan-1-ol

Drug info:

PubChemData

Smile

COCCCOCCSCCO

DOS

IR

Vibrations