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三水合硝酸N,N,N′,N′-四[(1′-苄基-2′-苯并咪唑)甲基]-1,2-环己二胺合Zn(Ⅱ)的晶体结构和非等温热分解反应动力学

Crystal Structure and Non-Isothermal Kinetics of Thermal Decomposition of N, N, N′, N′-Tetrakis [(1′-benzyl-2′-benzimdazolyl) methyl]-1,2-cyclohexanediamine Zinc(Ⅱ) Nitrate Trihydrate

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【作者】 李晓燕孙宏建杨兆荷

【Author】 Li, Xiao-Yan Sun, Hong-Jian(Department of Chemistry, Shandong University, Jinan, 250100)Yang, Zhao-He(Institute of Crystal Materials of Shandong University, Jinan, 250100)

【机构】 山东大学化学系山东大学晶体材料研究所 济南250100济南250100济南250100

【摘要】 本文报道标题Zn(Ⅱ)配合物:[Zn(NBOCTB)](NO32·3H2O的制备,晶体结构及热分解动力学.该晶体属三斜晶系,空间群p(?),a=1.4146(2),b=1.5407(3),c=1.8518(4)nm;α=62.09(2),β=72.46(2),γ=68.60(1)°.并对配合物第一和第二步热分解反应进行了非等温动力学研究.运用Achar法与Coats—Redfern法对非等温动力学数据进行分析,推断第一步脱水过程为成核和生长机理,其动力学方程为:dα/dt=Ae-E/RT,3/2(1-α)·[-In(1-α)]1/3;动力学补偿效应表达式为:InA=0.3739E-3.321.第二步分解过程为二级化学反应,其动力学方程为:dα/dt=Ae-E/RT(1-α)2;动力学补偿效应表达式为:InA=0.2100E-3.690.

【Abstract】 Synthesis and crystal structure of titled Zn(Ⅱ) coordination compound, [Zn(NBOCTB)] (NO3)2·3H2O, were reported in this paper. The complex belongs to triclinic system, space group P1 with a=1.4146(2), b= 1.5407(3), c= 1.8518(4)nm; α= 62.09(2), β= 72.46(2), γ = 68.60(l)°; V =3.2783(9)nm3, Mr=1238.68, Z=2, Dx=1.25g/ cm3, υ= 4.43cm-1, F(000)=1288. Non-isothermal kinetics of thermal decomposition of the complex was also studied with Achar method and Coats-Redfern method by TG and DTG techniques. The kinetic equation for the first step can be expressed as: dα/dt=Ae·(3/2)·3(1 -α)·3[ - ln(1 -α)]1/3 , the mechanism is"Coring and Growth" (n=1.5); while for the second step, dα/dt = Ae-E/RT·(1-α)2 , whichcorresponding to the mechanism of "the second-order chemical reaction". The mathematic expressions of the kinetic compensation effect for the two steps are found to be:lnA = 0.3739E-3.321, and lnA = 0.2100E-3.690, respectively.

【关键词】 Zn配合物晶体结构热分解动力学
【基金】 国家自然科学青年基金资助的课题
  • 【文献出处】 化学学报 ,Acta Chimica Sinica , 编辑部邮箱 ,1995年01期
  • 【分类号】O641
  • 【被引频次】1
  • 【下载频次】77
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