Geometry & MOs

Info

ID:

199247

PubChem CID:

79222526

Reduced:

SO2C16H16 (1)

Stoich.:

AB2C16D16 (1)

Weight, g/mol:

286.102751

ΔHf, kcal/mol:

-44.53

Dipole, Da:

2.41

IP(EA), eV:

-8.6(-0.04)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

1-[2-(2,3-dihydro-1-benzothiophen-2-ylmethoxy)phenyl]ethanol

Drug info:

PubChemData

Smile

C1C(SC2=CC=CC=C21)COC3=CC=CC(=C3)CO

DOS

IR

Vibrations