Geometry & MOs

Info

ID:

428109

PubChem CID:

135166130

Reduced:

N5H35C57 (1)

Stoich.:

A5B35C57 (1)

Weight, g/mol:

762.278347

ΔHf, kcal/mol:

295.88

Dipole, Da:

1.62

IP(EA), eV:

 -8.03(-1.22)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

5-[4-(4-phenylphenyl)quinazolin-2-yl]-12-triphenylen-2-ylindolo[3,2-c]carbazole

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=NC(=NC(=N2)C3=CC(=CC=C3)N4C5=C(C6=CC=CC=C64)C7=C(C=C5)C8=CC=CC=C8N7C9=CC1=C(C=C9)C2=CC=CC=C2C2=CC=CC=C21)C1=CC=CC=C1

DOS

IR

Vibrations