Geometry & MOs

Info

ID:

439960

PubChem CID:

135229831

Reduced:

ON2H32C51 (1)

Stoich.:

AB2C32D51 (1)

Weight, g/mol:

917.32938

ΔHf, kcal/mol:

199.63

Dipole, Da:

1.71

IP(EA), eV:

 -7.99(-0.71)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-(4-dibenzofuran-4-ylphenyl)-2-phenyl-N-(3-spiro[2-oxapentacyclo[12.8.0.03,12.04,9.017,22]docosa-1(14),3(12),4,6,8,10,15,17,19,21-decaene-13,9'-fluorene]-2'-ylphenyl)aniline

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)N2C3=CC=CC=C3N(C4=CC=CC=C42)C5=CC=CC6=C5C7=CC=CC=C7C68C9=C(C1=CC=CC=C1C=C9)OC1=C8C=CC2=CC=CC=C21

DOS

IR

Vibrations