六(苯氧基)环三磷腈中分子内激基复合物的形成：光物理性质、晶体结构和理论研究。
Intramolecular excimer formation in hexakis(pyrenyloxy)cyclotriphosphazene: photophysical properties, crystal structure, and theoretical investigation.
机构信息
Department of Chemistry, Gebze Institute of Technology, P.O. Box: 141, Gebze 41400, Kocaeli, Turkey.
出版信息
Dalton Trans. 2014 Mar 7;43(9):3428-33. doi: 10.1039/c3dt52957f.
A hexakis(pyrenyloxy)cyclotriphosphazene is synthesized by the reaction of N3P3Cl6 with 2-hydroxypyrene, and its excimer emission through intramolecular interactions in solution and in the solid state has been investigated by fluorescence spectroscopy and X-ray crystallography. Thermal and electrochemical properties were investigated. A DFT benchmark study has been performed to evaluate the intramolecular interactions and molecular orbital levels by comparing with the experimental results.
通过 N3P3Cl6 与 2-羟基芘的反应合成了六（芘氧基）环三磷腈，并通过荧光光谱和 X 射线晶体学研究了其在溶液和固态中的分子内相互作用的激基发射。研究了热性能和电化学性能。通过与实验结果进行比较，进行了 DFT 基准研究来评估分子内相互作用和分子轨道能级。
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