Geometry & MOs

Info

ID:

29650

PubChem CID:

836160

Reduced:

N2O4C14H19 (1)

Stoich.:

A2B4C14D19 (1)

Weight, g/mol:

345.172879

ΔHf, kcal/mol:

-138.23

Dipole, Da:

3.33

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 0.877554

Charge, e:

 0

Chem-info

IUPAC name:

N-(4-ethoxyphenyl)-3,3-diphenylpropanamide

Drug info:

PubChemData

Smile

CC1=[N+](C2=C(N1CCO)C=C(C=C2)C(=O)OC)CCO

DOS

IR

Vibrations