Geometry & MOs

Info

ID:

316493

PubChem CID:

126631005

Reduced:

NH13C18 (4)

Stoich.:

AB13C18 (4)

Weight, g/mol:

973.414447

ΔHf, kcal/mol:

268.42

Dipole, Da:

1.42

IP(EA), eV:

 -8.14(-1.28)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

5-[2,3-bis(11,11-dimethylindeno[1,2-b]carbazol-5-yl)quinoxalin-6-yl]-11,11-dimethylindeno[1,2-b]carbazole

Drug info:

PubChemData

Smile

CC1(C2=CC=CC=C2C3=C1C=C4C(=C3)C5=CC=CC=C5N4C6=C7C(=CC(=CC7=NC=C6)N8C9=CC=CC=C9C1=CC2=C(C=C18)C(C1=CC=CC=C12)(C)C)N1C2=CC=CC=C2C2=CC3=C(C=C21)C(C1=CC=CC=C13)(C)C)C

DOS

IR

Vibrations