Geometry & MOs

Info

ID:

315829

PubChem CID:

126628967

Reduced:

ON4H32C48 (1)

Stoich.:

AB4C32D48 (1)

Weight, g/mol:

770.268176

ΔHf, kcal/mol:

207.49

Dipole, Da:

1.77

IP(EA), eV:

-8.34(-1.26)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

11-[6-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-12,12-dimethylindeno[2,1-a]carbazole

Drug info:

PubChemData

Smile

CC1(C2=CC=CC=C2C3=C1C4=C(C=C3)C5=CC=CC=C5N4C6=CC7=C(C=C6)OC8=C7C=CC=C8C9=NC(=NC(=N9)C1=CC=CC=C1)C1=CC=CC=C1)C

DOS

IR

Vibrations