Geometry & MOs

Info

ID:

377386

PubChem CID:

134223436

Reduced:

ON4H40C61 (1)

Stoich.:

AB4C40D61 (1)

Weight, g/mol:

830.256943

ΔHf, kcal/mol:

243.76

Dipole, Da:

2.95

IP(EA), eV:

 -8.09(-0.91)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

7-(4-dibenzofuran-4-ylphenyl)-10-(7-phenyl-[1]benzofuro[2,3-b]carbazol-10-yl)-[1]benzofuro[2,3-b]carbazole

Drug info:

PubChemData

Smile

CC1(C2=CC=CC=C2C3=C1C=C4C(=C3)C5=C(N4C6=NC(=CC(=N6)C7=CC=CC=C7)C8=CC=CC=C8)C=CC(=C5)C9=CC1=C(C=C9)C2=C(O1)C=C1C(=C2)C2=CC=CC=C2N1C1=CC=CC=C1)C

DOS

IR

Vibrations