Geometry & MOs

Info

ID:

311297

PubChem CID:

126590311

Reduced:

NH18C27 (2)

Stoich.:

AB18C27 (2)

Weight, g/mol:

741.278013

ΔHf, kcal/mol:

232.91

Dipole, Da:

0.54

IP(EA), eV:

-8.1(-0.47)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

3-[3-[3-(7-dibenzofuran-4-yl-9-phenylcarbazol-3-yl)phenyl]carbazol-9-yl]aniline

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC(=CC=C2)C3=CC4=C(C=C3)N(C5=C4C=C(C=C5)C6=CC=C(C=C6)C7=CC8=C(C=C7)N(C9=CC=CC=C98)C1=CC=CC=C1)C1=CC=CC=C1

DOS

IR

Vibrations