Geometry & MOs

Info

ID:

394033

PubChem CID:

135022198

Reduced:

O4C15H24 (1)

Stoich.:

A4B15C24 (1)

Weight, g/mol:

322.172151

ΔHf, kcal/mol:

-192.46

Dipole, Da:

5.32

IP(EA), eV:

-10.29(-0.36)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

(2,3-dimethyl-4,5-diphenylcyclopenta-1,3-dien-1-yl)benzene

Drug info:

PubChemData

Smile

C[C@H]1CCCCC[C@H]2[C@@H](/C=C\C(=O)O1)OC(O2)(C)C

DOS

IR

Vibrations