Geometry & MOs

Info

ID:

377378

PubChem CID:

134223428

Reduced:

ON4H38C59 (1)

Stoich.:

AB4C38D59 (1)

Weight, g/mol:

755.239519

ΔHf, kcal/mol:

237.89

Dipole, Da:

4.21

IP(EA), eV:

 -8.05(-1.12)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2-(5,7-diphenylindolo[2,3-b]carbazol-2-yl)-7-phenyl-[1]benzothiolo[2,3-b]carbazole

Drug info:

PubChemData

Smile

CC1(C2=CC=CC=C2C3=C1C=C4C(=C3)C5=C(N4C6=NC7=CC=CC=C7C(=N6)C8=CC=CC=C8)C=CC(=C5)C9=CC1=C(C=C9)N(C2=C1C=C1C3=CC=CC=C3OC1=C2)C1=CC=CC=C1)C

DOS

IR

Vibrations