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Updated: May 3, 2026

Synthesis of Hypervalent Iodonium Alkynyl Triflates for the Application of Generating Cyanocarbenes
Published on: September 8, 2013
Isostructural Energetic Coordination Compounds Based on 1,2-Dimethylimidazole and Cyanoborohydride toward
Wen-Jing Yang1, Peng-Han Jiang1, Hao-Hui Xie1
1College of Material Engineering, Fujian Agriculture and Forestry University, Fuzhou 350108, P. R. China.
Abstract:
Advancement in spacecraft propulsion systems has driven the development of hypergolic materials with high volumetric energy density (Ev), short ignition delay (ID) time, and low sensitivity. Traditional unsymmetrical dimethylhydrazine (UDMH) suffers from unsatisfactory Ev, stringent storage requirements, and carcinogenicity. Energetic coordination compounds (ECCs) are promising hypergolic materials that combine high-energy organic components with active metal centers. However, achieving high-performance hypergolic ECCs and elucidating the structure-property relationship for ID time remains challenging. In this study, two isostructural hypergolic ECCs, [Cd(DMI)4(CBH)2] 1 and [Ni(DMI)4(CBH)2] 2, were constructed using 1,2-dimethylimidazole (DMI) as a ligand and cyanoborohydride (CBH-). Both compounds show high energy density, short ID time, and low sensitivity. Ni-based 2 has a higher Ev (31.97 kJ·cm-3) than UDMH (25.60 kJ·cm-3) and ZIF-based materials such as Zn(AIm)2 (19.30 kJ·cm-3) and Co(AIm)2 (19.50 kJ·cm-3). Upon contact with red fuming nitric acid (RFNA), compound 2 exhibits a shorter ID (14 ms) than 1 (19 ms). Theoretical calculations indicate that the shorter ID time of 2 arises from its higher HOMO energy level involving the Ni center, a more electron-rich metal center, and stronger interaction with HNO3, rendering 2 a promising hypergolic material with excellent properties.
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