Geometry & MOs

Info

ID:

52315

PubChem CID:

12015142

Reduced:

NOC8H11 (1)

Stoich.:

ABC8D11 (1)

Weight, g/mol:

254.13068

ΔHf, kcal/mol:

11.34

Dipole, Da:

5.38

IP(EA), eV:

-10.42(-0.32)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

4-hydroxy-5,5-diphenylpentan-2-one

Drug info:

PubChemData

Smile

CC/C(=C\C#N)/[C@@H]1[C@H](O1)C

DOS

IR

Vibrations