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Spectral and Luminescent Properties and NH-Tautomerism of Alkylated Corrole Free Bases
Journal of Applied Spectroscopy ( IF 0.7 ) Pub Date : 2020-07-16 , DOI: 10.1007/s10812-020-01017-y
Y. H. Ajeeb , D. V. Klenitsky , I. V. Vershilovskaya , D. V. Petrova , A. S. Semeikin , W. Maes , L. L. Gladkov , M. M. Kruk

The molecular structures and spectral and luminescent properties of 2,3,7,13,17,18-hexamethyl-8,12-di-nbutylcorrole and 7,13-dimethyl-8,12-di-n-butylcorrole free bases in solutions at 288–328 K were studied using luminescence and absorption spectroscopy and quantum chemistry. Absorption and fluorescence spectra of the compounds were shown to be superimposed spectra of two NH-tautomers. Individual tautomer spectra were identified. Bands were assigned to specific transitions. NH-tautomer equilibria in the ground S0 and lower excited S1 singlet states were characterized.

中文翻译:

烷基化的Corrole游离碱的光谱和发光性质以及NH-互变异构

溶液中2,3,7,13,17,18-六甲基-8,12-二正丁基cor和7,13-二甲基-8,12-二正丁基cor的游离分子的分子结构以及光谱和发光性质使用发光和吸收光谱以及量子化学研究了288–328 K时的温度。化合物的吸收光谱和荧光光谱显示为两种NH-互变异构体的叠加光谱。鉴定了各个互变异构体光谱。将频段分配给特定的过渡。表征了基态S 0和较低激发态S 1单峰态的NH-互变异构体平衡。
更新日期:2020-07-16
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