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Chlorinated Derivatives of C-78-Fullerene Isomers with Unusually Short Intermolecular Halogen-Halogen Contacts

机译:具有异常短的分子间卤素-卤素接触的C-78-富勒烯异构体的氯化衍生物

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摘要

The chlorinated fullerenes C-78(2)Cl-18 and C-78(3)Cl-18 were synthesized by highly selective chlorination of the individual isomers. They were crystallized as C-78(2)Cl18 center dot Br2-TiCl4 and solvent free C-78(3)Cl-18. The carbon connectivities of both isomers have been confirmed through X-ray single-crystal analysis. Studious investigation of both crystal packings together with the crystal structure of C-78(4)Cl-18 has revealed the presence of unusually short intermolecular halogen-halogen contacts. which provide evidence for attractive intermolecular interactions, the nature of which is discussed.
机译:氯化富勒烯C-78(2)Cl-18和C-78(3)Cl-18是通过单个异构体的高度选择性氯化而合成的。它们结晶为C-78(2)Cl18中心点Br2-TiCl4和无溶剂C-78(3)Cl-18。通过X射线单晶分析已经证实了两种异构体的碳连接性。对两种晶体堆积以及C-78(4)Cl-18晶体结构的勤奋研究表明,存在异常短的分子间卤素-卤素接触。它提供了有吸引力的分子间相互作用的证据,并对其性质进行了讨论。

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