Geometry & MOs

Info

ID:

310411

PubChem CID:

126579939

Reduced:

SN2H36C55 (1)

Stoich.:

AB2C36D55 (1)

Weight, g/mol:

756.25992

ΔHf, kcal/mol:

219.79

Dipole, Da:

3.44

IP(EA), eV:

 -7.95(-1.04)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

7-(4-dibenzothiophen-4-ylphenyl)-5-(11,11-dimethylbenzo[b]fluoren-2-yl)indolo[2,3-b]carbazole

Drug info:

PubChemData

Smile

CC1(C2=CC=CC=C2C3=C1C=C(C=C3)N4C5=CC=CC=C5C6=C4C=C7C(=C6)C8=CC=CC=C8N7C9=CC=C(C=C9)C1=CC2=CC=CC=C2C2=C1SC1=CC=CC=C12)C

DOS

IR

Vibrations