Geometry & MOs

Info

ID:

316485

PubChem CID:

126630992

Reduced:

O3N5H45C80 (1)

Stoich.:

A3B5C45D80 (1)

Weight, g/mol:

895.25834

ΔHf, kcal/mol:

308.59

Dipole, Da:

5.14

IP(EA), eV:

 -8.26(-1.48)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C3=C(N2C4=CC=CC(=C4)C5=CC6=C(C=C5)N=C(N=C6C7=CC(=CC=C7)N8C9=CC=CC=C9C1=C8C2=C(C=C1)OC1=CC=CC=C12)C1=CC(=CC=C1)N1C2=CC=CC=C2C2=C1C1=C(C=C2)OC2=CC=CC=C21)C1=C(C=C3)OC2=CC=CC=C21

DOS

IR

Vibrations