Synthesis and Properties of Tetranitro-Substituted Adamantane Derivatives

被引:28
作者
Klapoetke, Thomas M. [1 ]
Krumm, Burkhard [1 ]
Widera, Anna [1 ]
机构
[1] Ludwig Maximilians Univ Munchen, Dept Chem, Butenandtstr 5-13 D, D-81377 Munich, Germany
来源
CHEMPLUSCHEM | 2018年 / 83卷 / 01期
关键词
adamantane; explosives; high-energy dense materials; structure elucidation; SET MODEL CHEMISTRY; CRYSTAL-STRUCTURE; PREDICTION; MINIMUM;
D O I
10.1002/cplu.201700542
中图分类号
O6 [化学];
学科分类号
0703 ;
摘要
Several new nitro-substituted adamantane compounds based on adamantane-1,3,5,7-tetrol were synthesized and the previously only briefly reported tetranitrate was reinvestigated. The materials were completely characterized by spectroscopic methods including some by X-ray diffraction. The energetic properties, thermal stabilities, and sensitivities of the nitrocarbamate, nitrocarbamate salt, and nitrate were determined and compared to current composites in terms of potential high-energy dense oxidizers (HEDOs). Furthermore, the enthalpies of all compounds were calculated, and their energetic performances investigated by using the EXPLO5 code.
引用
收藏
页码:61 / 69
页数:9
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