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Novel Energetic Coordination Polymers Based on 1,5-Di(nitramino)tetrazole With High Oxygen Content and Outstanding Properties: Syntheses, Crystal Structures, and Detonation Properties
In this study, a series of novel 1,5-di(nitramino)tetrazole (DNAT)-based bimetallic energetic coordination polymers, MK(2)(DNAT)(2)·4H(2)O [M = Fe, Cu, Ni, Co, and Zn], were designed and synthesized in a simple and convenient self-assembly synthetic process. The obtained compounds were fully charact...
Autores principales: | , , , , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
Frontiers Media S.A.
2019
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6803599/ https://www.ncbi.nlm.nih.gov/pubmed/31681726 http://dx.doi.org/10.3389/fchem.2019.00672 |
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author | Li, Yanan Yu, Tao Zhang, Yiying Hu, Jianjian Chen, Tao Wang, Yinglei Xu, Kangzhen |
author_facet | Li, Yanan Yu, Tao Zhang, Yiying Hu, Jianjian Chen, Tao Wang, Yinglei Xu, Kangzhen |
author_sort | Li, Yanan |
collection | PubMed |
description | In this study, a series of novel 1,5-di(nitramino)tetrazole (DNAT)-based bimetallic energetic coordination polymers, MK(2)(DNAT)(2)·4H(2)O [M = Fe, Cu, Ni, Co, and Zn], were designed and synthesized in a simple and convenient self-assembly synthetic process. The obtained compounds were fully characterized by IR spectroscopy, multinuclear NMR spectroscopy, elemental analysis, and differential scanning calorimetry (DSC). Additionally, the structures of target compounds were confirmed by single-crystal X-ray diffraction. Based on the room-temperature X-ray densities (2.095–2.138 g cm(−3)) and the calculated (CBS–QB3) heats of formation (−41.3 to 170.5 kJ mol(−1)), the detonation properties such as detonation velocities (8,147.0–8,478.4 m s(−1)) and detonation pressures (29.7–32.8 GPa) were computed using the EXPLO5 v6.04 program. Their excellent energetic properties indicated that they could serve as promising “green” primary explosives for replacement of lead azide (LA). |
format | Online Article Text |
id | pubmed-6803599 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2019 |
publisher | Frontiers Media S.A. |
record_format | MEDLINE/PubMed |
spelling | pubmed-68035992019-11-03 Novel Energetic Coordination Polymers Based on 1,5-Di(nitramino)tetrazole With High Oxygen Content and Outstanding Properties: Syntheses, Crystal Structures, and Detonation Properties Li, Yanan Yu, Tao Zhang, Yiying Hu, Jianjian Chen, Tao Wang, Yinglei Xu, Kangzhen Front Chem Chemistry In this study, a series of novel 1,5-di(nitramino)tetrazole (DNAT)-based bimetallic energetic coordination polymers, MK(2)(DNAT)(2)·4H(2)O [M = Fe, Cu, Ni, Co, and Zn], were designed and synthesized in a simple and convenient self-assembly synthetic process. The obtained compounds were fully characterized by IR spectroscopy, multinuclear NMR spectroscopy, elemental analysis, and differential scanning calorimetry (DSC). Additionally, the structures of target compounds were confirmed by single-crystal X-ray diffraction. Based on the room-temperature X-ray densities (2.095–2.138 g cm(−3)) and the calculated (CBS–QB3) heats of formation (−41.3 to 170.5 kJ mol(−1)), the detonation properties such as detonation velocities (8,147.0–8,478.4 m s(−1)) and detonation pressures (29.7–32.8 GPa) were computed using the EXPLO5 v6.04 program. Their excellent energetic properties indicated that they could serve as promising “green” primary explosives for replacement of lead azide (LA). Frontiers Media S.A. 2019-10-15 /pmc/articles/PMC6803599/ /pubmed/31681726 http://dx.doi.org/10.3389/fchem.2019.00672 Text en Copyright © 2019 Li, Yu, Zhang, Hu, Chen, Wang and Xu. http://creativecommons.org/licenses/by/4.0/ This is an open-access article distributed under the terms of the Creative Commons Attribution License (CC BY). The use, distribution or reproduction in other forums is permitted, provided the original author(s) and the copyright owner(s) are credited and that the original publication in this journal is cited, in accordance with accepted academic practice. No use, distribution or reproduction is permitted which does not comply with these terms. |
spellingShingle | Chemistry Li, Yanan Yu, Tao Zhang, Yiying Hu, Jianjian Chen, Tao Wang, Yinglei Xu, Kangzhen Novel Energetic Coordination Polymers Based on 1,5-Di(nitramino)tetrazole With High Oxygen Content and Outstanding Properties: Syntheses, Crystal Structures, and Detonation Properties |
title | Novel Energetic Coordination Polymers Based on 1,5-Di(nitramino)tetrazole With High Oxygen Content and Outstanding Properties: Syntheses, Crystal Structures, and Detonation Properties |
title_full | Novel Energetic Coordination Polymers Based on 1,5-Di(nitramino)tetrazole With High Oxygen Content and Outstanding Properties: Syntheses, Crystal Structures, and Detonation Properties |
title_fullStr | Novel Energetic Coordination Polymers Based on 1,5-Di(nitramino)tetrazole With High Oxygen Content and Outstanding Properties: Syntheses, Crystal Structures, and Detonation Properties |
title_full_unstemmed | Novel Energetic Coordination Polymers Based on 1,5-Di(nitramino)tetrazole With High Oxygen Content and Outstanding Properties: Syntheses, Crystal Structures, and Detonation Properties |
title_short | Novel Energetic Coordination Polymers Based on 1,5-Di(nitramino)tetrazole With High Oxygen Content and Outstanding Properties: Syntheses, Crystal Structures, and Detonation Properties |
title_sort | novel energetic coordination polymers based on 1,5-di(nitramino)tetrazole with high oxygen content and outstanding properties: syntheses, crystal structures, and detonation properties |
topic | Chemistry |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6803599/ https://www.ncbi.nlm.nih.gov/pubmed/31681726 http://dx.doi.org/10.3389/fchem.2019.00672 |
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