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含能材料  2007 

高氯酸·四氨·双(5-硝基四唑)合钴(Ⅲ)(BNCP)的晶体结构

Keywords: 物理化学,起爆药,高氯酸·四氨·双(5-硝基四唑)合钴(Ⅲ)(BNCP),晶体结构,单斜晶系

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Abstract:

制备了高氯酸·四氨·双(5-硝基四唑)合钴(Ⅲ)(BNCP)的单晶,用X-ray单晶面探衍射仪对其晶体进行了结构测定。证实该晶体属单斜晶系,空间群为P2(1)/n。晶胞参数为:a=10.0149(11)?;b=10.5387(11)?;c=14.8241(16)?。V=1479.2(3)?3,Z=4,DC=2.050mg·mm-3,μ=1.421mm-1,F(000)=928,并得到了BNCP的原子坐标、等效温度因子、键长、键角和扭转角等数据。根据测试参数,分析了BNCP的结构特点和分解机理。

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