Coordinative Combination of Nitroamine and Gem-Dinitromethyl with Fused Ring for Enhanced Oxygen Balances and Detonation Properties DOI Open Access
Xun Zhang, Yaxi Wang,

Xinyuan Zhao

et al.

International Journal of Molecular Sciences, Journal Year: 2022, Volume and Issue: 23(22), P. 14337 - 14337

Published: Nov. 18, 2022

Oxygen balance and heat of formation are closely related to the nitrogen oxygen content in a molecule have significant effect on detonation performance energetic materials. Here new family 1,2,4-triazolo [4,3-b][1,2,4,5]-tetrazine containing gem-dinitromethyl nitroamine with high nitrogen-oxygen was synthesized characterized. Moreover, structure guanidine salt (3) TATOT (4) were confirmed by single-crystal X-ray diffraction. The ammonium 2 reached 82.5%, density (1.805 g cm-3) properties (D = 8900 m s-1; P 32.4 GPa), which similar those RDX.

Language: Английский

Recent advances in the synthesis and performance of 1,2,4,5-tetrazine-based energetic materials DOI Creative Commons
Леонид Л. Ферштат

FirePhysChem, Journal Year: 2022, Volume and Issue: 3(1), P. 78 - 87

Published: Sept. 20, 2022

In recent years, the development of novel advanced energetic materials has significantly shifted toward nitrogen heterocyclic derivatives, which demonstrate a great potential for multipurpose application patterns. Among known heterocycles tetrazine ring is well-known structural scaffold used in preparation various high-energy materials. The majority energy-rich substances incorporating subunit exhibit high thermal stability, good detonation performance and low sensitivity to mechanical stimuli defines their practical usability. this review, main achievements on synthesis tetrazine-based reported last decade are summarized. Potential applications presented compounds especially emphasized.

Language: Английский

Citations

28

Regulating the Thermal Stability and Energy of Fused-Ring Energetic Materials by Hydrazo Bridging and Hydrogen-Bonding Networks DOI
Sitong Chen, Lu Li, Siwei Song

et al.

Crystal Growth & Design, Journal Year: 2023, Volume and Issue: 23(7), P. 4970 - 4978

Published: June 2, 2023

In this work, a combined strategy of bridging two tetrazolo[1,5-b]pyridazine rings and introducing intramolecular hydrogen bonds (N–H···O) with hydrazo group was developed to construct new high-energy heat-resistant energetic compound named 6,6′-hydrazo-bis(8-amino-7-nitrotetrazolo[1,5-b]pyridazine) (1). Its dehydrogenated derivative 6,6′-azo-bis(8-amino-7-nitrotetrazolo[1,5-b]pyridazine) (2), which had fewer (N–H···O), also synthesized for comparison. Compounds 1 2 were characterized by high-resolution mass spectrometry, nuclear magnetic resonance, single-crystal X-ray diffraction, infrared spectroscopy, elemental analysis. Their properties, such as densities (ρ: 1.87 g·cm–3 1, 1.77 2), heat formation values (ΔHf: 1079 kJ·mol–1 1235 detonation velocities (Dv: 9064 m·s–1 8429 pressures (P: 35.2 GPa 27.8 decomposition temperatures (Td: 292 °C 260 impact sensitivities (IS: 16 J 4 friction (FS: >360 N 160 tested. These results suggest that is promising thermally stable material.

Language: Английский

Citations

10

An Intramolecular-Lock Facilitates Planar Tricyclic Fused Energetic Compounds DOI
Yubing Liu, Xun Zhang, Jie Li

et al.

Organic Letters, Journal Year: 2024, Volume and Issue: 26(26), P. 5488 - 5492

Published: June 20, 2024

Exploiting novel fused cyclic frameworks through simple and efficient methods has provided a blueprint for developing advanced explosives. In this study, six new [5,6,5]-tricyclic energetic compounds (I–VI) were synthesized an intramolecular cyclization strategy involving C-NH2 directed reaction. The work not only boosts the development of but also highlights their potential applications as secondary or heat-resistant

Language: Английский

Citations

3

Multiple Hydrogen-Bond Modification of [1,2,5]Oxadiazolo[3,4-b]pyridine 1-Oxide Framework Enables Access to Low-Sensitivity High-Energy Materials DOI

You Ran,

Siwei Song, Kangcai Wang

et al.

The Journal of Organic Chemistry, Journal Year: 2023, Volume and Issue: 88(13), P. 8929 - 8936

Published: May 30, 2023

In this work, a fused-ring [1,2,5]oxadiazolo[3,4-b]pyridine 1-oxide framework with multiple modifiable sites was utilized to develop novel energetic materials hydrogen bonds. The prepared were characterized, and their properties extensively investigated. Among those studied, compound 3 exhibited high densities of 1.925 g cm–3 at 295 K 1.964 170 K, detonation performances (Dv: 8793 m s–1 P: 32.8 GPa), low sensitivities (IS: 20 J, FS: 288 N), good thermal stability (Td: 223 °C). N-Oxide 4 had higher-energy explosive 8854 34.4 GPa) 15 J 240 N). Compound 7 enthalpy group (tetrazole) determined as high-energy 8851 s–1, 32.4 GPa). Notably, the compounds 3, 4, similar RDX 8801 33.6 results indicated that potential low-sensitivity materials.

Language: Английский

Citations

8

Iodine-containing furazan compounds: a promising approach to high-performance energetic biocidal agents DOI
Jinjie Chang, Lu Hu, Siping Pang

et al.

Journal of Materials Chemistry A, Journal Year: 2023, Volume and Issue: 11(29), P. 15979 - 15985

Published: Jan. 1, 2023

Four iodine-containing furazan compounds as promising biocidal agents with high iodine content (>50%) and TNT-like detonation performance were designed synthesized by simple step.

Language: Английский

Citations

8

Quantum-Chemical Calculations of the Enthalpy of Formation for 5/6/5 Tricyclic Tetrazine Derivatives Annelated with Nitrotriazoles DOI
В. М. Волохов, Vladimir V. Parakhin, E. S. Amosova

et al.

Russian Journal of Physical Chemistry B, Journal Year: 2024, Volume and Issue: 18(1), P. 28 - 36

Published: Feb. 1, 2024

Language: Английский

Citations

2

Tailoring Transition Metals and Biuret into Laser-Ignitable Energetic Coordination Polymers with Improved Oxygen Balance and Multidentate Coordination Structures DOI
Lu Zhang, Tingwei Wang,

Wen‐Shuai Dong

et al.

Crystal Growth & Design, Journal Year: 2023, Volume and Issue: 23(3), P. 1959 - 1971

Published: Feb. 1, 2023

Eight kinds of energetic coordination polymers (ECPs) with multi-coordination were designed and synthesized by combining the carbonyl group potential in biuret transition metal nitrates perchlorates (Co2+, Ni2+, Cu2+, Ag+). The structures these complexes are confirmed infrared spectroscopy, elemental analysis, X-ray single-crystal diffraction. physical chemical performance test results show that solvent-free ECPs 7 (Cu(BIU)2(ClO4)2) has best (Tdec = 328 °C, D 7600 km·s–1, P 27.8 Gpa, IS 25 J, FS 240 N). Among them, 8 (Ag(BIU)ClO4) have good detonation during hot plate laser ignition tests (ECPs 7: 15 W, τ 6 ms, E 80 mJ; 8: 20 5 100 mJ). result shows improving oxygen balance ligands constructing multidentate may be a new effective strategy for laser-sensitive ECPs.

Language: Английский

Citations

6

Is everything correct? The formation enthalpy estimation and data revision of nitrate and perchlorate salts DOI
Dmitry V. Khakimov, T. S. Pivina

Journal of Molecular Modeling, Journal Year: 2023, Volume and Issue: 29(3)

Published: Feb. 24, 2023

Language: Английский

Citations

6

Increasing the Energy Limit of Single Triazole–Tetrazole: HNANTT Modified with Its Energetic Coordination Polymers, Co-Crystals, and Energetic Salts DOI

Guofeng Zhang,

Chuan Xiao, Zhen Dong

et al.

Crystal Growth & Design, Journal Year: 2023, Volume and Issue: 23(9), P. 6756 - 6764

Published: July 27, 2023

A series of novel energetic materials (EMs) based on a single triazole–tetrazole material, (Z)-N-(5-nitro-2-(1H-tetrazol-5-yl)-2,4-dihydro-3H-1,2,4-triazol-3-ylidene)nitramide (HNANTT) with tremendous physicochemical (d = 1.833 g cm–3 and ΔHf 715.8 kJ mol–1) properties (Dv 9209 m s–1 P 36.38 GPa), were obtained. Detailed crystal structures HNANTT NANTT-5, 7, 8, 9, 11, 13 determined by single-crystal X-ray diffraction. Based HNANTT, three kinds coordination polymers (ECPs) (NANTT-5, 8), four salts (NANTT-9, 10, 12), one cocrystal (NANTT-13) prepared characterized to develop EMs different advantages. By modifying all NANTT derivatives (except NANTT-10) showed good mechanical sensitivity (IS > 40 J, FS 360 N), NANTT-ECP-8 achieving the highest density (2.729 cm–3) thermal stability (287 °C), NANTT-12 has detonation performances 9225 30.87 GPa) among materials, while co-crystal exhibited best comprehensive performance, superior 9035 30.12 higher (236 N + O content 83.2%.

Language: Английский

Citations

4

In search of the most thermostable 1,1,1-trinitrocompounds: polynitroethyl-substituted sym-tetrazine and bistriazolotetrazine DOI

Gennady F. Rudakov,

Valery P. Sinditskii, Valery V. Serushkin

et al.

Journal of Thermal Analysis and Calorimetry, Journal Year: 2023, Volume and Issue: 149(5), P. 2119 - 2136

Published: Dec. 24, 2023

Language: Английский

Citations

4