Geometry & MOs

Info

ID:

325310

PubChem CID:

126682676

Reduced:

N2H12C19 (2)

Stoich.:

A2B12C19 (2)

Weight, g/mol:

701.257946

ΔHf, kcal/mol:

195.88

Dipole, Da:

2.18

IP(EA), eV:

 -8.27(-1.1)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

8-phenyl-15-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]-8,10,12-triazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2,4,6,9,11,13,15-octaene

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC3=C4C(=C2)C=CC=C4N(C5=NC=NC=C35)C6=CC=CC(=C6)N7C8=CC=CC=C8C9=CC=CC=C97

DOS

IR

Vibrations