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Structure of ammonium hydrogen succinate at 80 and 20 K

机译:琥珀酸氢铵在80和20 K下的结构

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The crystal structure of ammonium hydrogen succinate has been determined at 80 and 20 K in order to clarify the structural change at the second-order phase transition at 170 K. The geometries of all the hydrogen bonds in the structure were analyzed by combining new geometric data with data obtained previously at 297, 190 and 150 K. The O ... O distances of two O-H ... O hydrogen bonds involving the hydrogen succinate ions increase as the temperature decreases below T-c and the N ... O distance of a weak bifurcated hydrogen bond involving the ammonium ion decreases below T-c. It is noted that the phase transition occurs so that the bifurcated hydrogen bond is retained below T-c. There was no evidence of a descent in space group from P (1) over bar to P1 below T-c and the formation of a superstructure below T-c was not detected. [References: 9]
机译:已确定在80和20 K下测定琥珀酸氢铵的晶体结构,以阐明在170 K下的二级相变时的结构变化。通过结合新的几何数据,分析了结构中所有氢键的几何形状使用先前在297、190和150 K处获得的数据。涉及琥珀酸氢根离子的两个OH ... O氢键的O ... O距离随着温度降低到Tc以下和a的N ... O距离而增加。涉及铵离子的弱分叉氢键降低到Tc以下。注意到发生相变,使得分叉的氢键保持在T-c以下。没有证据表明空间群从棒上的P(1)下降到T-c以下的P1,并且未检测到T-c以下的上部结构的形成。 [参考:9]

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