Geometry & MOs

Info

ID:

148360

PubChem CID:

53788022

Reduced:

NOC11H17 (1)

Stoich.:

ABC11D17 (1)

Weight, g/mol:

300.11503

ΔHf, kcal/mol:

-16.45

Dipole, Da:

4.35

IP(EA), eV:

-8.79(-0.08)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

4-(2,2-diphenylethenyl)benzoic acid

Drug info:

PubChemData

Smile

CCN1CCC=C(C1)C(=O)C2CC2

DOS

IR

Vibrations