Geometry & MOs

Info

ID:

316458

PubChem CID:

126630951

Reduced:

O3N4H32C59 (1)

Stoich.:

A3B4C32D59 (1)

Weight, g/mol:

894.263091

ΔHf, kcal/mol:

216.58

Dipole, Da:

2.78

IP(EA), eV:

 -8.27(-1.3)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

11-[4,6-bis([1]benzofuro[3,2-b]carbazol-11-yl)quinolin-7-yl]-[1]benzofuro[3,2-b]carbazole

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C3=C(N2C4=C(N=C(C=C4)N5C6=CC=CC=C6C7=C5C=C8C9=CC=CC=C9OC8=C7)N1C2=CC=CC=C2C2=C1C=C1C4=CC=CC=C4OC1=C2)C=C1C2=CC=CC=C2OC1=C3

DOS

IR

Vibrations