6533b833fe1ef96bd129b7fe

RESEARCH PRODUCT

Exploring the effect of the cyclometallating ligand in 2-(pyridine-2-yl)benzo[d]thiazole-containing iridium(III) complexes for stable light-emitting electrochemical cells

Antonio PertegásEnrique OrtíJosé M. Junquera-hernándezCristina MomblonaCathrin D. ErtlCatherine E. HousecroftEdwin C. ConstableHenk J. BolinkMichele Sessolo

subject

Materials sciencePhotoluminescenceLigandIonic bondingchemistry.chemical_element02 engineering and technologyGeneral ChemistryElectroluminescence010402 general chemistry021001 nanoscience & nanotechnology01 natural sciences0104 chemical scienceschemistry.chemical_compoundCrystallographychemistryPyridineMaterials ChemistryDensity functional theoryIridium0210 nano-technologyThiazole

description

The preparation and characterization of a series of iridium(III) ionic transition-metal complexes for application in light-emitting electrochemical cells (LECs) are reported. The complexes are of the type [Ir(C^N)2(N^N)][PF6] in which C^N is one of the cyclometallating ligands 2-(3-(tert-butyl)phenyl)pyridine (tppy), 2-phenylbenzo[d]thiazole (pbtz), 1-phenyl-1H-pyrazole (ppz) and 1-phenylisoquninoline (piq), and N^N is 2-(pyridine-2-yl)benzo[d]thiazole (btzpy). The variation in the C^N ligands allows the HOMO energy level to be tuned, leading to HOMO–LUMO gaps in the range 2.76–3.01 eV and values of Eox1/2 of 0.81–1.11 V. In solution, the complexes are orange to deep-red emitters (λmax in the range 600–660 nm), with quantum yields between 2% for [Ir(tppy)2(btzpy)][PF6] and 41% for [Ir(pbtz)2(btzpy)][PF6]. Similar trends for the emission maxima and photoluminescence quantum yields are observed in the solid state. Density functional theory (DFT) calculations support the charge transfer nature of the emission. Very bright electroluminescence was observed for LECs containing [Ir(pbtz)2(btzpy)][PF6], although the device was not stable under continuous operation; this is attributed to an unbalanced charge distribution and/or to a fast ionic migration. Significantly, LECs fabricated with [Ir(tppy)2(btzpy)][PF6] in the active layer are very stable, produce pure red emission and show no signs of degradation over a period of 5 days of continuous operation.

https://dx.doi.org/10.5451/unibas-ep66992