Geometry & MOs

Info

ID:

412756

PubChem CID:

135085673

Reduced:

O3C11H16 (1)

Stoich.:

A3B11C16 (1)

Weight, g/mol:

214.19328

ΔHf, kcal/mol:

-145.31

Dipole, Da:

4.06

IP(EA), eV:

-10.22(-0.25)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

6,10-dimethylundec-4-ene-1,10-diol

Drug info:

PubChemData

Smile

CC1=CC(=O)C(C1)C(=O)OC(C)(C)C

DOS

IR

Vibrations