Geometry & MOs

Info

ID:

199031

PubChem CID:

79190572

Reduced:

OC6H7 (2)

Stoich.:

AB6C7 (2)

Weight, g/mol:

204.11503

ΔHf, kcal/mol:

-56.77

Dipole, Da:

2.74

IP(EA), eV:

-8.78(0.04)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

1-(2,3-dihydro-1-benzofuran-5-yl)-3-methylbut-2-en-1-ol

Drug info:

PubChemData

Smile

CC(=C)C(C1=CC2=C(C=C1)OCC2)O

DOS

IR

Vibrations