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三苯基鏻-亚甲基三氟硼酸盐的晶体结构

Crystal structure of triphenylphosphonium-meth-yl-enetrifluoroborate.

作者信息

Bateman Christopher M, Zakharov Lev N, Abbey Eric R

机构信息

Dept. of Chemistry, Biochemistry, and Physics, Eastern Washington University, Cheney, WA 99004, USA.

Department of Chemistry and Biochemistry, CAMCOR, University of Oregon, Eugene, OR 97403, USA.

出版信息

Acta Crystallogr E Crystallogr Commun. 2017 Jul 7;73(Pt 8):1140-1142. doi: 10.1107/S2056989017009884. eCollection 2017 Jul 1.

DOI:10.1107/S2056989017009884
PMID:28932423
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC5598835/
Abstract

The title compound, CHBFP {alternative name: triphen-yl[(tri-fluoro-boran-yl)meth-yl]phosphanium}, was formed by the reaction of tri-phenyl-phosphine with potassium iodo-methyl-tri-fluoro-borate. The mol-ecule features a nearly staggered conformation along the P-C bond and a less than staggered conformation along the C-B bond. In the crystal, weak C-H⋯F hydrogen bonds between the -phenyl C-H groups and the tri-fluoro-borate B-F groups form chains of (16) rings along [100]. These chains are are further stabilized by weak C-H⋯π inter-actions. A weak intra-molecular C-H⋯F hydrogen bond is also observed.

摘要

标题化合物CHBFP(别名:三苯基[(三氟硼烷基)甲基]鏻)由三苯基膦与碘甲基三氟硼酸钾反应形成。分子沿P-C键呈现近乎交错的构象,沿C-B键呈现小于交错的构象。在晶体中,苯基C-H基团与三氟硼酸盐B-F基团之间的弱C-H⋯F氢键沿[100]形成(16)环的链。这些链通过弱C-H⋯π相互作用进一步稳定。还观察到一个弱的分子内C-H⋯F氢键。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/6a26/5598835/9d43073afadb/e-73-01140-fig3.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/6a26/5598835/3f0801a871cc/e-73-01140-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/6a26/5598835/ce9e60106023/e-73-01140-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/6a26/5598835/9d43073afadb/e-73-01140-fig3.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/6a26/5598835/3f0801a871cc/e-73-01140-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/6a26/5598835/ce9e60106023/e-73-01140-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/6a26/5598835/9d43073afadb/e-73-01140-fig3.jpg

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