Geometry & MOs

Info

ID:

323117

PubChem CID:

126672675

Reduced:

IO4H15C25 (1)

Stoich.:

AB4C15D25 (1)

Weight, g/mol:

1098.317389

ΔHf, kcal/mol:

-34.24

Dipole, Da:

2.74

IP(EA), eV:

 -8.75(-1.2)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

9-(8-carbazol-9-yldibenzothiophen-2-yl)-3-[4-[[2-(2-diphenylphosphorylphenoxy)phenyl]-(3-methylcyclohexa-1,5-dien-1-yl)phosphoryl]phenyl]carbazole

Drug info:

PubChemData

Smile

C1=CC(=CC2=C1C=CC3=C2C(C4=C(O3)C=CC5=C4C=C(C=C5)O)C6=CC=C(O6)I)O

DOS

IR

Vibrations