Geometry & MOs

Info

ID:

428111

PubChem CID:

135166132

Reduced:

ON5H33C57 (1)

Stoich.:

AB5C33D57 (1)

Weight, g/mol:

762.278347

ΔHf, kcal/mol:

272.48

Dipole, Da:

1.97

IP(EA), eV:

 -8.24(-1.33)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=NC(=NC(=N2)N3C4=C(C5=CC=CC=C53)C6=C(C=C4)C7=CC=CC=C7N6C8=CC9=C(C=C8)C1=CC=CC=C1C1=CC=CC=C19)C1=CC2=C(C=C1)C1=CC=CC=C1O2

DOS

IR

Vibrations