Geometry & MOs

Info

ID:	279617
PubChem CID:	103844472
Reduced:	O3C13H20 (1)
Stoich.:	A3B13C20 (1)
Weight, g/mol:	258.09258
ΔH_f, kcal/mol:	-125.46
Dipole, Da:	4.63
IP(EA), eV:	-8.67(0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(3-methylsulfonylpropoxy)phenyl]ethanol

Drug info:

PubChemData

Smile

CCOCCCOC1=CC=C(C=C1)CCO

DOS

IR

Vibrations