Geometry & MOs

Info

ID:

441259

PubChem CID:

135233849

Reduced:

O2N3H29C49 (1)

Stoich.:

A2B3C29D49 (1)

Weight, g/mol:

677.246713

ΔHf, kcal/mol:

192.22

Dipole, Da:

1.62

IP(EA), eV:

 -8.77(-1.2)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2-phenyl-4-[9-(4-phenylnaphthalen-1-yl)dibenzofuran-2-yl]-6-(3-phenylphenyl)-1,3,5-triazine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=NC(=NC(=N2)C3=CC=CC4=C3OC5=CC=CC=C45)C6=CC7=C(C=C6)OC8=CC=CC(=C87)C9=CC=C(C=C9)C1=CC=CC2=CC=CC=C21

DOS

IR

Vibrations