Borazine-based compound and application thereof in organic electronic device
A technology of organic electronic devices and compounds, applied in the field of new borazane-based compounds
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[0149] 1. Synthesis of Compounds F1-F4
[0150]
[0151] The general synthesis route, at room temperature (300K), the anion of carbazole reacts with cyanoborazine fluoride under nitrogen atmosphere for 16 hours. The resulting product was purified by column chromatography on silica gel and reprecipitated. Compounds were further purified by sublimation before measuring photoluminescence and electroluminescence spectra.
[0152] 2. Energy structure of compounds F1-F4
[0153] The energy structures of compounds F1-F4 can be obtained by quantum calculation, such as using TD-DFT (time-dependent density functional theory) through Gaussian03W (Gaussian Inc.). For specific simulation methods, please refer to WO2011141110. First, the semi-empirical method "Ground State / Semi-empirical / Default Spin / AM1" (Charge0 / Spin Singlet) is used to optimize the molecular geometry, and then the energy structure of the organic molecule is calculated by the TD-DFT (time-dependent density functional...
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