Geometry & MOs

Info

ID:

448816

PubChem CID:

135293778

Reduced:

NH17C26 (2)

Stoich.:

AB17C26 (2)

Weight, g/mol:

249.15175

ΔHf, kcal/mol:

236.54

Dipole, Da:

1.94

IP(EA), eV:

 -7.98(-0.55)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

4-[(E)-[(6Z)-6-[(Z)-but-2-enylidene]cyclohexa-2,4-dien-1-ylidene]methyl]-N-methylaniline

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC=C(C=C2)C3=CC(=NC4=CC=CC=C43)C5=CC=CC6=C5C7(C8=CC=CC=C68)C9=CC=CC=C9N(C1=CC=CC=C71)C1=CC=CC=C1

DOS

IR

Vibrations