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Low-frequency vibrational properties of crystalline and glassy indomethacin probed by terahertz time-domain spectroscopy and low-frequency Raman scattering

机译:太赫兹时域光谱和低频拉曼散射探测的结晶和玻璃吲哚美辛的低频振动特性

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摘要

In order to clarify the intermolecular vibrations, the low-frequency modes of the glassy and crystalline states of model pharmaceutical indomethacin have been studied using broadband terahertz time-domain spectroscopy and low-frequency Raman scattering. In the crystalline gamma-form, the center of symmetry was suggested by the observation of the exclusion principle of the infrared (IR) and Raman selection rules in the frequency range between 0.2 and 6.5 THz. In addition, a boson peak of the glassy state was observed in both IR and Raman spectra and their frequency showed apparent discrepancy. The intermediate correlation length of the glassy structure was estimated to be about 2.5 nm. The existence of hydrogen bonded cyclic dimers in a glassy state was suggested by the observation of the infrared active intermolecular vibrational mode of the hydrogen bonded cyclic dimers as a broad peak at 3.0 THz in the IR spectrum. (c) 2015 Elsevier B.V. All rights reserved.
机译:为了阐明分子间的振动,已使用宽带太赫兹时域光谱和低频拉曼散射研究了模型药物吲哚美辛的玻璃态和结晶态的低频模式。在晶体伽马形式中,通过观察红外(IR)和拉曼选择规则在0.2到6.5 THz频率范围内的排除原理,可以提出对称中心。另外,在IR和拉曼光谱中都观察到玻态的玻色子峰,并且它们的频率显示出明显的差异。玻璃状结构的中间相关长度估计为约2.5nm。通过观察氢键合的环状二聚体的红外活性分子间振动模式在IR谱中的3.0THz处的宽峰,表明存在玻璃态的氢键合的环状二聚体。 (c)2015 Elsevier B.V.保留所有权利。

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