Deuterium Perturbs the Molecular Arrangement in the Solid State

Merz Klaus; Kupka Anna

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Deuterium Perturbs the Molecular Arrangement in the Solid State

机译：氘干扰固态的分子排列

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Hydrogen/deuterium (H/D) exchange is generally seen as a negligible criterion in the formation of the crystal structures of chemical compounds. On the other hand, it can be shown that the aggregation of molecules in the solid state of selected organic and inorganic compounds can be very sensitive to the small H/D change in the isotopic substitution pattern of the considered molecules or the use of deuterated solvents during the crystallization process. This perspective highlights the extraordinary aggregation behavior in certain cases of deuterated versus nondeuterated small inorganic and organic compounds.

机译：氢/氘（H / D）交换通常被视为化合物晶体结构形成中的可忽略标准。另一方面，可以证明所选有机和无机化合物固态的分子聚集对所考虑分子的同位素取代模式中的小H / D变化或使用氘代溶剂非常敏感在结晶过程中。这种观点强调了氘化与非氘化的无机和有机小化合物在某些情况下的异常聚集行为。

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《Crystal growth & design》 |2015年第4期|共6页
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Merz Klaus; Kupka Anna;
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中图分类晶体学;
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1. Deuterium Perturbs the Molecular Arrangement in the Solid State [J] . Merz Klaus, Kupka Anna Crystal growth & design . 2015,第4期

机译：氘干扰固态的分子排列
2. Molecular collective dynamics in solid para-hydrogen and ortho-deuterium: The Parrinello-Rahman-type path integral centroid molecular dynamics approach [J] . Saito H., Nagao H., Nishikawa K., The Journal of Chemical Physics . 2003,第2期

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3. Solid-solid phase interconversion in an organic conductor crystal: hydrogen-bond-mediated dynamic changes in π-stacked molecular arrangement and physical properties [J] . Junya Yoshida, Akira Ueda, Akiko Nakao, Chemical Communications . 2014,第98期

机译：有机导体晶体中的固-固相互变：氢键介导的π堆积分子排列和物理性质的动态变化
4. STUDY OF MOLECULAR MOTIONS IN EPOXY NETWORKS USING SOLID STATE DEUTERIUM NMR [C] . Samuel J. Tucker, Abdelwahed R. Sayed, William L. Jarrett, SAMPE 2010 conference and exhibition . 2010

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5. Application of a classical variational theory of chemical reaction rates to the fluorine + molecular hydrogen going to hydrogen fluoride + hydrogen and fluorine + hydrogen-deuterium going to deuterium fluoride (hydrogen fluoride) + hydrogen (deuterium) reactions [D] . Rutenburg, Irina 1995

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6. Donor–acceptor stacking arrangements in bulk and thin-film high-mobility conjugated polymers characterized using molecular modelling and MAS and surface-enhanced solid-state NMR spectroscopy [O] . Sachin R. Chaudhari, John M. Griffin, Katharina Broch, 2017

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7. Verification of the Intermolecular Parallel β-Sheet in E22K-Aβ42 Aggregates by Solid-State NMR Using Rotational Resonance: Implications for the Supramolecular Arrangement of the Toxic Conformer of Aβ42 [O] . Yuichi MASUDA, Azusa NAKANISHI, Ryutaro OHASHI, 2008

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8. Differential cross section for the reactive scattering of deuterium atoms by hydrogen molecules - Cross sections for the excitation of Na/3 2P/ by collisions with internally excited molecular hydrogen, deuterium and nitrogen [R] . Krause, H. F. 1970

机译：氢分子对氘原子反应散射的微分截面 - 通过与内部激发的分子氢，氘和氮的碰撞激发Na / 3 2p的截面

Deuterium Perturbs the Molecular Arrangement in the Solid State

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