Geometry & MOs

Info

ID:

379102

PubChem CID:

134352372

Reduced:

NH45C66 (1)

Stoich.:

AB45C66 (1)

Weight, g/mol:

813.314398

ΔHf, kcal/mol:

280.27

Dipole, Da:

0.53

IP(EA), eV:

 -7.9(-0.73)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2-carbazol-9-yl-9-[4-[4-[2-(9H-fluoren-9-yl)carbazol-9-yl]phenyl]phenyl]carbazole

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2(C3=CC=CC=C3C4=CC=CC5=C4C2=CC=C5)C6=CC=C(C=C6)C7=CC=C(C=C7)N(C8=CC=CC=C8)C9=CC1=C(C=C9)C2=CC=CC=C2C1(C1=CC=CC=C1)C1=CC=CC=C1

DOS

IR

Vibrations