Geometry & MOs

Info

ID:

220728

PubChem CID:

85230774

Reduced:

OC3H4 (4)

Stoich.:

AB3C4 (4)

Weight, g/mol:

224.17763

ΔHf, kcal/mol:

-81.63

Dipole, Da:

2.61

IP(EA), eV:

-10.1(0.11)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

tricyclo[8.4.0.05,14]tetradecane-1,13-diol

Drug info:

PubChemData

Smile

C=CCOC1C=CC(OC1CO)OCC#C

DOS

IR

Vibrations