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1-(硝基亚甲基)-5-四唑:一种用于激光点火配位化合物的具有改善氧平衡的高灵敏度配体。

1-(Nitratomethyl)-5-tetrazole: A Highly Sensitive Ligand with Improved Oxygen Balance for Laser-Ignitable Coordination Compounds.

作者信息

Kofen Moritz, Braun Vanessa, Endraß Simon M J, Klapötke Thomas M, Stierstorfer Jörg

机构信息

Department of Chemistry, Ludwig Maximilian University Munich, 81377 Munich, Germany.

出版信息

Inorg Chem. 2022 Oct 31;61(43):17212-17225. doi: 10.1021/acs.inorgchem.2c02805. Epub 2022 Oct 16.

Abstract

For the first time, the highly sensitive 1-(nitratomethyl)-5-tetrazole (1-NAMT) was synthesized, representing the shortest possible 1-(nitratoalkyl)-5-tetrazole with a combined nitrogen and oxygen content of 81.4%. Compared to its related ethyl derivative, 1-(nitratoethyl)-5-tetrazole, it exhibits improved oxygen balance, resulting in higher detonation parameters. 1-NAMT was thoroughly analyzed by single-crystal diffraction experiments accompanied by elemental analysis, IR spectroscopy, and multinuclear (H, C, and N) NMR measurements. The thermal behavior of 1-NAMT was analyzed by differential thermal analysis supported by thermogravimetric analysis. Furthermore, energetic coordination compounds (ECCs) of Cu with different inorganic (, nitrate, chlorate, and perchlorate) and nitroaromatic anions (, picrate and styphnate) were synthesized and thoroughly analyzed. It is shown that the formation of ECCs with nitroaromatic anions ( ∼ 180 °C) is a suitable strategy to improve the rather low thermal stability of 1-NAMT (125 °C).

摘要

首次合成了高灵敏度的1-(硝甲基)-5-四唑(1-NAMT),它是最短的1-(硝酸烷基)-5-四唑,氮氧总含量为81.4%。与相关的乙基衍生物1-(硝酸乙酯基)-5-四唑相比,它的氧平衡有所改善,从而具有更高的爆轰参数。通过单晶衍射实验并结合元素分析、红外光谱和多核(H、C和N)核磁共振测量对1-NAMT进行了全面分析。通过差示热分析并辅以热重分析对1-NAMT的热行为进行了分析。此外,还合成并全面分析了铜与不同无机阴离子(硝酸盐、氯酸盐和高氯酸盐)以及硝基芳族阴离子(苦味酸盐和斯蒂酚酸盐)形成的高能配位化合物(ECCs)。结果表明,与硝基芳族阴离子形成ECCs(约180℃)是提高1-NAMT相当低的热稳定性(125℃)的合适策略。

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