Geometry & MOs

Info

ID:

51317

PubChem CID:

12013963

Reduced:

NO2C20H25 (1)

Stoich.:

AB2C20D25 (1)

Weight, g/mol:

1312.778994

ΔHf, kcal/mol:

-83.44

Dipole, Da:

2.59

IP(EA), eV:

 -9.25(0.07)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

4-[(E)-2-[4-[(E)-2-[4-[(E)-2-[4-[(E)-2-[4-[(E)-2-(2,5-dipropoxyphenyl)ethenyl]-2,5-dipropoxyphenyl]ethenyl]-2,5-dipropoxyphenyl]ethenyl]-2,5-dipropoxyphenyl]ethenyl]-2,5-dipropoxyphenyl]ethenyl]-2,5-dipropoxybenzaldehyde

Drug info:

PubChemData

Smile

CC1=C(CC2C(C1)C(=O)N(C2=O)C3=CC=CC=C3C(C)(C)C)C

DOS

IR

Vibrations