Geometry & MOs

Info

ID:

399143

PubChem CID:

135038179

Reduced:

SiO3C16H24 (1)

Stoich.:

AB3C16D24 (1)

Weight, g/mol:

188.120115

ΔHf, kcal/mol:

-153.97

Dipole, Da:

4.81

IP(EA), eV:

-9.39(-0.13)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

(1R,5R,6S)-2,2,5-trimethyltricyclo[4.4.0.01,5]deca-7,9-dien-4-one

Drug info:

PubChemData

Smile

C/C(=C\OC)/C(=O)CC(C1=CC=CC=C1)O[Si](C)(C)C

DOS

IR

Vibrations