Geometry & MOs

Info

ID:

32305

PubChem CID:

6436446

Reduced:

O7C11H18 (1)

Stoich.:

A7B11C18 (1)

Weight, g/mol:

218.167065

ΔHf, kcal/mol:

-301.66

Dipole, Da:

2.57

IP(EA), eV:

-10.4(-0.84)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

(E)-3-methyl-4-(8-tricyclo[5.2.1.02,6]dec-4-enyl)but-3-en-2-ol

Drug info:

PubChemData

Smile

CCOC(=O)/C=C(\C(=O)OCC(C)O)/OCCO

DOS

IR

Vibrations