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Molecular motion in solid ammonia trimethylalane

机译:固体氨三甲基铝烷中的分子运动

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Solid state H-2 NMR has been used to study molecular motion in deuterated ammonia trimethylalane (CH3)(3)AlND3. From analysis of the H-2 NMR lineshape between 123 and 298 K, reorientation of the -ND3 group about the molecular Al-N axis is shown to occur at a rate higher than 10(8) s(-1), and simulation of partially relaxed H-2 NMR lineshapes shows that the reorientation can be described as a 3-site 120degrees jump motion. From the temperature dependence of the H-2 spin-lattice relaxation time, the activation energy for this motion is estimated to be 9.3 +/- 0.3 kJ mol(-1). There is no evidence from either H-2 or Al-27 NMR data for any site-exchange between the sites occupied by the -ND3 and -CH3 groups. The anisotropy of the dynamics of (CH3)(3)AlND3 indicates that the orientation of the Al-N bond is highly constrained, presumably by a strong interaction between the electric dipoles of neighboring molecules. (C) 2003 Elsevier Inc. All rights reserved. [References: 42]
机译:固态H-2 NMR已用于研究氘化氨三甲基铝(CH3)(3)AlND3中的分子运动。根据123和298 K之间的H-2 NMR线形分析,显示-ND3基团围绕分子Al-N轴的重取向以高于10(8)s(-1)的速率发生,并且模拟了部分松弛的H-2 NMR线形表明重新取向可以描述为3位120度跳跃运动。根据H-2自旋晶格弛豫时间的温度依赖性,此运动的活化能估计为9.3 +/- 0.3 kJ mol(-1)。从H-2或Al-27 NMR数据都没有证据表明-ND3和-CH3基团占据的位点之间发生任何位点交换。 (CH3)(3)AlND3动力学的各向异性表明,Al-N键的方向受到高度限制,这大概是由于相邻分子的电偶极子之间的强相互作用引起的。 (C)2003 Elsevier Inc.保留所有权利。 [参考:42]

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