Geometry & MOs

Info

ID:

315832

PubChem CID:

126628973

Reduced:

ON2H34C50 (1)

Stoich.:

AB2C34D50 (1)

Weight, g/mol:

894.31071

ΔHf, kcal/mol:

174.0

Dipole, Da:

2.0

IP(EA), eV:

-8.05(-1.01)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

5-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-12-(9-phenylcarbazol-3-yl)indolo[3,2-c]carbazole

Drug info:

PubChemData

Smile

CC1(C2=CC=CC=C2C3=C1C=C4C(=C3)C5=CC=CC=C5N4C6=CC7=C(C=C6)OC8=C7C=CC=C8C9=CC(=CC(=N9)C1=CC=CC=C1)C1=CC=CC=C1)C

DOS

IR

Vibrations