Geometry & MOs

Info

ID:

386582

PubChem CID:

134982225

Reduced:

NO2C18H21 (1)

Stoich.:

AB2C18D21 (1)

Weight, g/mol:

299.1674

ΔHf, kcal/mol:

-29.64

Dipole, Da:

6.93

IP(EA), eV:

-8.27(0.28)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

(E)-3-(2,5-diphenylcyclopenta-2,4-dien-1-ylidene)-N,N-dimethylprop-1-en-1-amine

Drug info:

PubChemData

Smile

CN(C)C1=CC(=C(C=C1)[C@@H](CC=O)C2=CC=CC=C2)OC

DOS

IR

Vibrations