Preprint Article Version 1 Preserved in Portico This version is not peer-reviewed

Development of Blue Phosphorescent Pt(II) Materials using Dibenzofuranyl Imidazole Ligands and their Application in Organic Light-Emitting Diodes

Version 1 : Received: 9 May 2023 / Approved: 9 May 2023 / Online: 9 May 2023 (10:25:25 CEST)

A peer-reviewed article of this Preprint also exists.

Kim, H.; Cho, D.; Kim, H.; Kim, S.C.; Lee, J.Y.; Kang, Y. Development of Blue Phosphorescent Pt(II) Materials Using Dibenzofuranyl Imidazole Ligands and Their Application in Organic Light-Emitting Diodes. Materials 2023, 16, 4159. Kim, H.; Cho, D.; Kim, H.; Kim, S.C.; Lee, J.Y.; Kang, Y. Development of Blue Phosphorescent Pt(II) Materials Using Dibenzofuranyl Imidazole Ligands and Their Application in Organic Light-Emitting Diodes. Materials 2023, 16, 4159.

Abstract

Organic light-emitting diodes (OLEDs) are energy-efficient; however, the coordinating ligand can affect their stability. Sky-blue phosphorescent Pt(II) complexes with a C^N chelate, fluorinated-dbi (dbi = [1-(2,4-diisopropyldibenzo[b,d]furan-3-yl)-2-phenyl-1H-imidazole]), and acetylactonate (acac)(1)/picolinate (pic)(2) ancillary ligands were synthesized. The molecular structures were characterized using various spectroscopic methods. The Pt(II) coordination sphere in 2 exhibited a distorted square-planar geometry, with several intra- and inter-molecular interactions involving Cπ⋯H/Cπ⋯Cπ stacking. Complex 1 emitted bright sky-blue light (λmax = 485 nm) with a moderate photoluminescent quantum efficiency of 0.37 and short decay time (6.1 µs) compared to those of 2. Time-dependent density functional theory calculations suggested that the electronic transition of 1 arose from ligand(C^N)-centered π–π* transitions combined with metal-to-ligand charge transfer transitions (MLCT), whereas that of 2 arose from MLCT and ligand(C^N)-to-ligand(pic) charge transfer (LLCT), with minimal contribution from the C^N chelate to the lowest unoccupied molecular orbital. Multi-layered phosphorescent OLEDs using 1 as a dopant and a mixed host, 3,3-di(9H-carbazol-9-yl)-1,1-biphenyl:3-di(9H-carbazol-9-yl)-1,1-biphenyl (mCBP)/9-(3’-carbazol-9-yl-5-cyano-biphenyl-3-yl)-9H-carbazole-3-carbonitrile (CNmCBPCN) were successfully fabricated. At a 10% doping of 1, a current efficiency of 13.6 cd A−1 and external quantum efficiency of 8.4 % at 100 cd m−2 were achieved. These results show that the ancillary ligand in phosphorescent Pt(II) complexes must be considered.

Keywords

phosphorescent organic light-emitting diodes; heteroleptic Pt(II) complexes; C^N chelate; ancillary ligand; time-dependent density functional theory

Subject

Chemistry and Materials Science, Materials Science and Technology

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