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Synthesis and Characterization of Nonclassical Interhalides Based on Bromine Monochloride
Angewandte Chemie International Edition ( IF 16.6 ) Pub Date : 2018-06-19 , DOI: 10.1002/anie.201803705
Benjamin Schmidt 1 , Karsten Sonnenberg 1 , Helmut Beckers 1 , Simon Steinhauer 1 , Sebastian Riedel 1
Affiliation  

Due to a more distinct σ‐hole, BrCl is able to form stronger halogen bonds than those in polyhalogen anions based on Cl2 and Br2. This stabilization allows the crystallographic characterization of a variety of new polyinterhalides, in which chloride functions as the central ion as shown by the molecular structures of [AsPh4][Cl(BrCl)3] and [CCl(NMe2)2][Cl(BrCl)5]. Furthermore, the solid‐state structure of an octahedrally coordinated nonclassical interhalide is reported for the first time. The tridecainterhalide monoanion [Cl(BrCl)6] consists of a central chloride ion, which is coordinated by six BrCl molecules in a slightly distorted octahedral structure. All new compounds were characterized by single‐crystal X‐ray diffraction (XRD), NMR and Raman spectroscopy, as well as quantum‐chemical calculations.

中文翻译:

基于一氯化溴的非经典卤化物的合成与表征

由于存在更独特的σ孔,因此与基于Cl 2和Br 2的多卤素阴离子相比,BrCl能够形成更强的卤素键。这种稳定作用使得可以对各种新型的聚卤化物进行晶体学表征,其中氯化物起着中心离子的作用,如[AsPh 4 ] [Cl(BrCl)3 ]和[CCl(NMe 22 ] [Cl (BrCl)5 ]。此外,首次报道了八面体配位的非经典卤化物的固态结构。十三间卤化物单阴离子[Cl(BrCl)6 ] -由一个中央氯离子组成,该氯离子由六个略呈扭曲的八面体结构的BrCl分子配位。所有新化合物都通过单晶X射线衍射(XRD),NMR和拉曼光谱以及量子化学计算来表征。
更新日期:2018-06-19
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