AI Article Synopsis

  • N-nitration of 2,6-diamino-3,5-dinitropyrazine results in the creation of a new energetic compound, N,N'-(3,5-dinitropyrazine-2,6-diyl)dinitramide, along with stabilized salts.
  • Both salts, dipotassium and diammonium variants, are characterized using single-crystal X-ray diffraction, revealing a stable 3D energetic metal-organic framework (EMOF) structure in one of the compounds.
  • The compounds display notable performance characteristics, including high experimental density and thermal stability, with one compound showing exceptional detonation performance metrics suitable for potential energetic material applications.

Article Abstract

N-nitration of 2,6-diamino-3,5-dinitropyrazine (ANPZ) leads to a sensitive energetic compound N,N'-(3,5-dinitropyrazine-2,6-diyl)dinitramide. This nitro(nitroamino) compound was stabilized by synthesizing energetic salts, dipotassium (3,5-dinitropyrazine-2,6-diyl)bis(nitroamide) () and diammonium (3,5-dinitropyrazine-2,6-diyl)bis(nitroamide) (). Compounds and are fully characterized by single-crystal X-ray diffraction. Compound exhibits a three-dimensional energetic metal-organic framework (3D EMOF) structure and an outstanding overall performance by combining high experimental density (2.10 g cm), good thermal stability ( = 220 °C), and good calculated performance of detonation ( = 8300 m s, = 29.9 GPa). Compound has acceptable thermal stability (155 °C), moderate experimental density (1.73 g cm), and good calculated performance of detonation ( = 8624 m s, = 30.8 GPa). The sensitivities of compounds and toward impact and friction were determined following standard methods (BAM). The energetic character of compounds and was determined using red-hot needle and heated plate tests. The results highlight a 3D EMOF () based on a six-membered heterocycle as a potential energetic material.

Download full-text PDF

Source
http://dx.doi.org/10.1021/acs.inorgchem.2c02800DOI Listing

Publication Analysis

Top Keywords

energetic salts
8
experimental density
8
thermal stability
8
good calculated
8
calculated performance
8
performance detonation
8
energetic
6
salts sensitive
4
sensitive nn'-35-dinitropyrazine-26-diyldinitramide
4
nn'-35-dinitropyrazine-26-diyldinitramide stabilized
4

Similar Publications

Dissolution, solvation and diffusion in low-temperature zinc electrolyte design.

Nat Rev Chem

January 2025

Key Laboratory of Advanced Energy Materials Chemistry (Ministry of Education), College of Chemistry, Nankai University, Tianjin, China.

Aqueous zinc-based batteries have garnered the attention of the electrochemical energy storage community, but they suffer from electrolytes freezing and sluggish kinetics in cold environments. In this Review, we discuss the key parameters necessary for designing anti-freezing aqueous zinc electrolytes. We start with the fundamentals related to different zinc salts and their dissolution and solvation behaviours, by highlighting the effects of anions and additives on salt solubility, ion diffusion and freezing points.

View Article and Find Full Text PDF

Prediction of the Specific Energy of Supercapacitors with Polymeric Materials Using Advanced Molecular Dynamics Simulations.

Polymers (Basel)

December 2024

Department of Communications, Faculty of Electronics, Telecommunications and Information Technologies, "Politehnica" University of Timisoara, V. Pârvan Blvd., No. 2, 300223 Timisoara, Romania.

Supercapacitor/pseudocapacitor structures with electrodes and electrolytes based on conductive polymers, but not only, have been analyzed using techniques. Results indicated in the literature were used to confirm the results obtained for the specific capacitance and energetic performances of the systems. New material classes like Polymer-MXene electrodes ((PANI)/TiC, PFDs/TiCT) present increased capacitance in comparison with simple polymeric composites (PETC or PTh).

View Article and Find Full Text PDF

Metal-containing compounds form a large and rapidly expanding group of high-energy materials. Many compounds in this class attract the attention of non-professionals, who may attempt the illegal production of explosives. Several of these substances have been commercially available and pose significant danger if used by terrorists or for criminal purposes.

View Article and Find Full Text PDF

In this study, the electrochemical coupling of nitrosoarenes with ammonium dinitramide is discovered, leading to the facile construction of the nitro--azoxy group, which represents an important motif in the design of energetic materials. Compared to known approaches to nitro--azoxy compounds involving two chemical steps (formation of azoxy group containing a leaving group and its nitration) and demanding expensive, corrosive, and hygroscopic nitronium salts, the presented electrochemical method consists of a single step and is based solely on nitrosoarenes and ammonium dinitramide. The dinitramide salt plays the roles of both the electrolyte and reactant for the coupling.

View Article and Find Full Text PDF

The functionalization of pyrazole-based compounds with dinitromethyl and -hydroxytetrazole groups resulted in enhanced energetic properties. Two key compounds, 5-(dinitromethyl)-3,4-dinitro-1-pyrazole () and 5-(3,4-dinitro-1-pyrazol-5-yl)-1-tetrazol-1-ol (), along with their salts, were synthesized and evaluated for their energetic properties. Notably, the bishydroxylammonium salts (: 8778 m·s; : 33.

View Article and Find Full Text PDF

Want AI Summaries of new PubMed Abstracts delivered to your In-box?

Enter search terms and have AI summaries delivered each week - change queries or unsubscribe any time!