A theoretical study on the mechanistic highlights behind the Brønsted-acid dependent mer–fac isomerization of homoleptic carbenic iridium complexes for PhOLEDs-Reference-Cited by-同舟云学术

A theoretical study on the mechanistic highlights behind the Brønsted-acid dependent mer–fac isomerization of homoleptic carbenic iridium complexes for PhOLEDs

Published:2017 Issue:22 Volume:46 Page:7194-7209
ISSN:1477-9226
Container-title:Dalton Transactions
language:en
Short-container-title:Dalton Trans.

Author:

Setzer Tobias¹²³⁴^ORCID,Lennartz Christian⁵⁶⁴,Dreuw Andreas⁷⁸⁹⁴^ORCID

Affiliation:

1. BASF SE

2. ROM/CQ – B009

3. 67056 Ludwigshafen am Rhein

4. Germany

5. trinamiX GmbH

6. 67063 Ludwigshafen am Rhein

7. Interdisziplinäres Zentrum für Wissenschaftliches Rechnen

8. Ruprecht-Karls-Universität Heidelberg

9. 69120 Heidelberg

Abstract

The strongly acid-dependent mer–fac isomerization reaction of homoleptic carbenic iridium complexes used in PhOLEDs has been investigated quantum chemically.

Publisher

Royal Society of Chemistry (RSC)

Subject

Inorganic Chemistry

Link

http://pubs.rsc.org/en/content/articlepdf/2017/DT/C7DT01201B

Reference53 articles.

1. Identification of an iridium(III) complex with anti-bacterial and anti-cancer activity

2. A Highly Reactive Dicationic Iridium(III) Catalyst for the Polarized Nazarov Cyclization Reaction

3. Phosphorescent Sensor for Biological Mobile Zinc

4. Sensory luminescent iridium(III) and platinum(II) complexes for cation recognition

5. Nearly 100% internal phosphorescence efficiency in an organic light-emitting device

Cited by 5 articles. 订阅此论文施引文献订阅此论文施引文献，注册后可以免费订阅5篇论文的施引文献，订阅后可以查看论文全部施引文献

1. The acid-mediated isomerization of iridium(iii) complexes with cyclometalated NHC ligands: kinetic vs. thermodynamic control;Dalton Transactions;2023

2. Effects of geometrical isomerism on emissive behaviour of heteroleptic cyclometalated Ir(iii) complexes;Dalton Transactions;2021

3. Unraveling the Degradation Mechanism of FIrpic-Based Blue OLEDs: I. A Theoretical Investigation;Chemistry of Materials;2019-03-05

4. Facial and Meridional Isomers of Tris(bidentate) Ir(III) Complexes: Unravelling Their Different Excited State Reactivity;Inorganic Chemistry;2018-09-17

5. The short device lifetimes of blue PhOLEDs: insights into the photostability of blue Ir(iii) complexes;Chem. Sci.;2017