Geometry & MOs

Info

ID:

325355

PubChem CID:

126682877

Reduced:

N2H26C39 (1)

Stoich.:

A2B26C39 (1)

Weight, g/mol:

672.256549

ΔHf, kcal/mol:

171.85

Dipole, Da:

1.6

IP(EA), eV:

 -8.03(-0.76)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

15-phenyl-8-[3-(3-triphenylen-2-ylphenyl)phenyl]-8,11-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9(17),10,12,14-octaene

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC(=CC=C2)C3=CC(=CC=C3)N4C5=CC=CC=C5C6=C7C4=NC=CC7=CC(=C6)C8=CC=CC=C8

DOS

IR

Vibrations