Stipurin Sergej, Strassner Thomas
Physikalische Organische Chemie, Technische Universität Dresden, 01069 Dresden, Germany.
Inorg Chem. 2021 Aug 2;60(15):11200-11205. doi: 10.1021/acs.inorgchem.1c01172. Epub 2021 Jul 9.
The combination of strong electron-withdrawing groups in cyclometalated N-heterocyclic carbene ligands (C^C*) with known beneficial auxiliary ligands in phosphorescent platinum(II) complexes leads to efficient light-to-deep-blue emission with quantum yields of up to 92%. All compounds were characterized and investigated regarding their photophysical, electrochemical, and thermal properties, and three complexes could additionally be characterized by solid-state structures. Density functional theory calculations (PBE0/6-311G* with dispersion correction) are reported.
环金属化N-杂环卡宾配体(C^C*)中强吸电子基团与磷光铂(II)配合物中已知的有益辅助配体相结合,可实现高效的光致深蓝色发射,量子产率高达92%。对所有化合物的光物理、电化学和热性质进行了表征和研究,其中三种配合物还通过固态结构进行了表征。报道了密度泛函理论计算(采用色散校正的PBE0/6-311G*)。