Matches in SemOpenAlex for { <https://semopenalex.org/work/W2983086273> ?p ?o ?g. }
- W2983086273 endingPage "7216" @default.
- W2983086273 startingPage "7206" @default.
- W2983086273 abstract "The investigation of high-nitrogen compounds has been significant for the evolution of energetic materials. Azo-bis-1,2,4-triazole (aTRz) can be an excellent energetic backbone, owing to its characteristics: high heat of formation, high nitrogen content, and plane structure. Nevertheless, aTRz-based energetic compounds have been rarely synthesized using the covalent modification method, owning to the decomposition of aTRz under harsh reaction conditions. Cocrystallization has been widely used as a mild and efficient method for modulating the properties of energetic compounds. In this study, electrostatic potential (ESP) maps were used for theoretical guidance, and four aTRz-based energetic cocrystals have been obtained via cocrystallization. The single-crystal structures of these cocrystals indicated that the N···H–N hydrogen bonds between the side nitrogen atoms of aTRz and the amino groups of the nitro azole compounds were the driving force for the assembly of multimers with aTRz and polynitroazole compounds. Consequently, the formation of cocrystals via the self-assembly of these multimers was driven by other weak hydrogen bonds and van der Waals forces. The detonation performance of aTRz-based cocrystals was increased by appropriately selecting the coformers. Particularly, when 4-amino-3,5-dinitro-pyrazole (ADNP) was used as coformer, resultant cocrystal 3 was a potential high-energy density material that exhibited high density, high detonation velocity (8329 m s–1) and detonation pressure (28.6 GPa). Thus, in this study, cocrystallization has been demonstrated to be an effective method for the noncovalent modification of aTRz-based energetic materials." @default.
- W2983086273 created "2019-11-22" @default.
- W2983086273 creator A5013915196 @default.
- W2983086273 creator A5022091275 @default.
- W2983086273 creator A5032761492 @default.
- W2983086273 creator A5060566156 @default.
- W2983086273 creator A5067658743 @default.
- W2983086273 creator A5077322975 @default.
- W2983086273 creator A5080935093 @default.
- W2983086273 date "2019-11-05" @default.
- W2983086273 modified "2023-10-14" @default.
- W2983086273 title "Noncovalent Modification of 4,4′-Azo-1,2,4-triazole Backbone via Cocrystallization with Polynitroazoles" @default.
- W2983086273 cites W1909641936 @default.
- W2983086273 cites W1952537039 @default.
- W2983086273 cites W1963703539 @default.
- W2983086273 cites W1982134120 @default.
- W2983086273 cites W1986410571 @default.
- W2983086273 cites W1992759862 @default.
- W2983086273 cites W2014298942 @default.
- W2983086273 cites W2030624798 @default.
- W2983086273 cites W2041501527 @default.
- W2983086273 cites W2047746320 @default.
- W2983086273 cites W2085701033 @default.
- W2983086273 cites W2093428858 @default.
- W2983086273 cites W2093517513 @default.
- W2983086273 cites W2098222684 @default.
- W2983086273 cites W2100585808 @default.
- W2983086273 cites W2115972111 @default.
- W2983086273 cites W2168039830 @default.
- W2983086273 cites W2284877964 @default.
- W2983086273 cites W2316408286 @default.
- W2983086273 cites W2317584950 @default.
- W2983086273 cites W2322036385 @default.
- W2983086273 cites W2324954331 @default.
- W2983086273 cites W2326987670 @default.
- W2983086273 cites W2327420463 @default.
- W2983086273 cites W2331240409 @default.
- W2983086273 cites W2517567184 @default.
- W2983086273 cites W2605980264 @default.
- W2983086273 cites W2606170717 @default.
- W2983086273 cites W2609980140 @default.
- W2983086273 cites W2762816554 @default.
- W2983086273 cites W2770866911 @default.
- W2983086273 cites W2806784560 @default.
- W2983086273 cites W2936233043 @default.
- W2983086273 cites W2971396983 @default.
- W2983086273 doi "https://doi.org/10.1021/acs.cgd.9b01069" @default.
- W2983086273 hasPublicationYear "2019" @default.
- W2983086273 type Work @default.
- W2983086273 sameAs 2983086273 @default.
- W2983086273 citedByCount "17" @default.
- W2983086273 countsByYear W29830862732020 @default.
- W2983086273 countsByYear W29830862732021 @default.
- W2983086273 countsByYear W29830862732022 @default.
- W2983086273 countsByYear W29830862732023 @default.
- W2983086273 crossrefType "journal-article" @default.
- W2983086273 hasAuthorship W2983086273A5013915196 @default.
- W2983086273 hasAuthorship W2983086273A5022091275 @default.
- W2983086273 hasAuthorship W2983086273A5032761492 @default.
- W2983086273 hasAuthorship W2983086273A5060566156 @default.
- W2983086273 hasAuthorship W2983086273A5067658743 @default.
- W2983086273 hasAuthorship W2983086273A5077322975 @default.
- W2983086273 hasAuthorship W2983086273A5080935093 @default.
- W2983086273 hasConcept C100687433 @default.
- W2983086273 hasConcept C112887158 @default.
- W2983086273 hasConcept C126061179 @default.
- W2983086273 hasConcept C137277065 @default.
- W2983086273 hasConcept C147597530 @default.
- W2983086273 hasConcept C152365726 @default.
- W2983086273 hasConcept C154238967 @default.
- W2983086273 hasConcept C178790620 @default.
- W2983086273 hasConcept C180577832 @default.
- W2983086273 hasConcept C185592680 @default.
- W2983086273 hasConcept C203397868 @default.
- W2983086273 hasConcept C2778026756 @default.
- W2983086273 hasConcept C2779171751 @default.
- W2983086273 hasConcept C32909587 @default.
- W2983086273 hasConcept C33347731 @default.
- W2983086273 hasConcept C5716244 @default.
- W2983086273 hasConcept C8010536 @default.
- W2983086273 hasConceptScore W2983086273C100687433 @default.
- W2983086273 hasConceptScore W2983086273C112887158 @default.
- W2983086273 hasConceptScore W2983086273C126061179 @default.
- W2983086273 hasConceptScore W2983086273C137277065 @default.
- W2983086273 hasConceptScore W2983086273C147597530 @default.
- W2983086273 hasConceptScore W2983086273C152365726 @default.
- W2983086273 hasConceptScore W2983086273C154238967 @default.
- W2983086273 hasConceptScore W2983086273C178790620 @default.
- W2983086273 hasConceptScore W2983086273C180577832 @default.
- W2983086273 hasConceptScore W2983086273C185592680 @default.
- W2983086273 hasConceptScore W2983086273C203397868 @default.
- W2983086273 hasConceptScore W2983086273C2778026756 @default.
- W2983086273 hasConceptScore W2983086273C2779171751 @default.
- W2983086273 hasConceptScore W2983086273C32909587 @default.
- W2983086273 hasConceptScore W2983086273C33347731 @default.
- W2983086273 hasConceptScore W2983086273C5716244 @default.
- W2983086273 hasConceptScore W2983086273C8010536 @default.
- W2983086273 hasFunder F4320321001 @default.