3,7-二硝基亚氨基-2,4-二氮杂双环[3,3,0]辛烷的放热分解反应动力学

来源 :化学物理学报 | 被引量 : 0次 | 上传用户:xuezhenqian
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在程序升温条件下,用DSC研究了标题化合物的放热分解反应动力学.用线性最小二乘法、迭代法以及二分法与最小二乘法相结合的方法,以积分方程、微分方程和放热速率方程拟合DSC数据.在逻辑选择建立了微分和积分机理函数的最可几一般表达式后,用放热速率方程得到相应的表观活化能(Ea)、指前因子(A)和反应级数(n)的值.结果表明:该反应的微分形式的经验动力学模式函数、 Ea和A值分别为(1-α)0.44、 230.4 kJ/mol和1018.16s-1.借助加热速率和所得动力学参数值,提出了标题化合物放热分解反应的动力学方程.该化合物的热爆炸临界温度为302.6℃.上述动力学参数对分析、评价标题化合物的稳定性和热变化规律十分有用.
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