Geometry & MOs

Info

ID:

428127

PubChem CID:

135166180

Reduced:

ON5H31C51 (1)

Stoich.:

AB5C31D51 (1)

Weight, g/mol:

762.278347

ΔHf, kcal/mol:

255.53

Dipole, Da:

2.46

IP(EA), eV:

 -8.16(-1.31)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC(=CC=C2)N3C4=C(C5=CC=CC=C53)C6=C(C=C4)C7=CC=CC=C7N6C8=NC(=NC(=N8)C9=CC1=C(C=C9)C2=CC=CC=C2O1)C1=CC=CC=C1

DOS

IR

Vibrations