一个扭曲的基于四醇的分子向具有更好的热稳定性和不敏感性的高能材料的triazole诱导的平面化
Zhaoyang Yin1, Lijincao Hu1, Wei Huang1
1School of Chemistry and Chemical Engineering, Nanjing University of Science and Technology, Nanjing 210094, China. huang_wei@njust.edu.cn.
一个新的三醇诱导的平面化策略增强了能量材料. 这种方法提高了热稳定性,降低了灵敏度,创造了与HMX相比的先进爆炸物.
科学领域:
- 材料科学 材料科学 材料科学
- 化学 化学 化学
背景情况:
- 结构平面化是提高材料能量性能的关键.
- 目前开发平面爆炸物的方法严重依赖研究人员的直觉和试错.
研究的目的:
- 引入一种新的三醇诱导平面化策略,用于设计先进的能量材料.
- 为了研究结合三环对分子平面性,芳香性,电荷分布和结合的影响.
主要方法:
- 在5-amino-1-nitriminotetrazole (VII) 中加入了一个三醇环,以创建一个平面能量材料,N-[5-amino-1-(1H-tetrazol-5-yl) -1H-1,2,4-triazol-3-yl]nitramide (3).
- 对母化合物和新材料的热稳定性 (Td) 和机械灵敏度 (冲击灵敏度[IS],摩擦灵敏度[FS]) 进行了评估.
- 基于平面材料 (3) 合成和表征了一种能量盐 (5).
主要成果:
- 平面材料 (3) 与非平面前体 VII (Td = 85 °C; IS < 0.25 J; FS < 5 N) 相比,显著提高了热稳定性 (145 °C) 和降低了灵敏度 (IS = 20 J; FS > 360 N).
- 能量盐 (5) 显示出优异的整体性能,包括9342 m s-1的爆炸速度 (Dv),31.6 GPa的压力 (P),201 °C的热稳定性 (Td) 和降低的灵敏度 (IS = 20 J;FS = 360 N),与HMX.
- 结果验证了三醇诱导平面化策略的有效性.
结论:
- 三醇诱导的平面化策略通过提高热稳定性和降低灵敏度,成功提高了高能材料的性能.
- 该战略提供了一种系统的方法,用于合理设计新型高性能能量材料.
- 开发的平面能量材料及其盐对需要先进的爆炸性质的应用具有前途.
更多相关视频
10:42Preparation of N-2-alkoxyvinylsulfonamides from N-tosyl-1,2,3-triazoles and Subsequent Conversion to Substituted Phthalans and Phenethylamines
Published on: January 3, 2018
06:34Synthesis of Antiviral Tetrahydrocarbazole Derivatives by Photochemical and Acid-catalyzed C-H Functionalization via Intermediate Peroxides CHIPS
Published on: June 20, 2014
相关概念视频
Aromatic Hydrocarbon Cations: Structural Overview
Removing one hydrogen from the intervening CH2 group...
Crystal Field Theory - Tetrahedral and Square Planar Complexes
Crystal field theory (CFT) is applicable to molecules in geometries other than octahedral. In octahedral complexes, the lobes of the dx2−y2 and dz2 orbitals point directly at the ligands. For tetrahedral complexes, the d orbitals remain in place, but with only four ligands located between the axes. None of the orbitals points directly at the tetrahedral ligands. However, the dx2−y2 and dz2 orbitals (along the Cartesian axes) overlap with the ligands less than the dxy,...
Stability of Conjugated Dienes
A comparison of the enthalpies of hydrogenation of dienes reveals that conjugated dienes release less heat on hydrogenation, rendering them more stable than their nonconjugated analogs.
Conformations of Cyclohexane
The chair form is the most stable and derives its name from its resemblance to the “easy chair.” In the chair conformation, two carbon atoms are arranged out-of-plane — one above and one below, minimizing the torsional strain. In the chair form, the bond angle is very close to the ideal...
Thermal and Photochemical Electrocyclic Reactions: Overview
Thermal Electrocyclic Reactions: Stereochemistry
Selection Rules: Thermal Activation
Conjugated systems containing an even number of π-electron pairs undergo a conrotatory ring closure. For example, thermal electrocyclization of (2E,4E)-2,4-hexadiene, a conjugated diene containing two π-electron pairs, gives trans-3,4-dimethylcyclobutene.
