Geometry & MOs

Info

ID:

426445

PubChem CID:

135144189

Reduced:

N4H32C49 (1)

Stoich.:

A4B32C49 (1)

Weight, g/mol:

616.226312

ΔHf, kcal/mol:

251.39

Dipole, Da:

1.04

IP(EA), eV:

 -8.3(-1.18)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

9-(4-dibenzofuran-2-yl-6-phenyl-1,3,5-triazin-2-yl)-2-naphthalen-2-yl-3,4-dihydrocarbazole

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=NC(=NC(=N2)C3=CC=C(C=C3)C4=CC=C(C=C4)N5C6=CC=CC=C6C7=C5C=C(C=C7)C8=CC=CC9=CC=CC=C98)C1=CC=CC=C1

DOS

IR

Vibrations