Cr-β沸石的合成与催化性能研究

在SiO₂-Cr₂O₃-(TEA)₂O-Na₂O-H₂O体系中，以四乙基氢氧化铵(TEAOH)为模板剂合成了Cr-β沸石，用XRD、IR、SEM及DTA-TGA等方法对样品进行了表征，探讨了反应混合物组成对Cr-β沸石晶化的影响，初步考查了Cr-β沸石催化苯酚与过氧化氢的羟基化反应活性。     

Study on the Dynamics of Blending of Glucomannan with Carrageenan and Guaran Gum

In order to prove up the interaction between konjac glucomannan (KGM) and other amyloses, by using KGM, guaran gum and carrageenan as materials, their blending in different external conditions was modeled by means of molecular dynamics (MD) method. The result showed that 323 K was a significant turning point for the formation of hydrogen bond, and KGM and guaran gum were just juxtaposed together via intermolecular hydrogen bond; but with the addition of carrageenan, KGM, guaran gum and carrageenan were spirally twisted together, and when their blending proportion is 3:2:9 the combination was the most compact. Moreover, the research result has provided the sequent studies afterwards on amyloses with some references.     

An IR Study on Adsorption of CO and NO on Copper Ion-exchanged Zeolite Beta

Thee adsorption of CO and NO on copper ion-exchanged zeolite Beta was investigated using IR method.It was found that the thermalvacuum pretreatment procedure could result in the reduction of Cu2 ions in zeolite Beta.The adsorption of CO on Cu sites in zeolite Beta closely follows Langmuir isotherm.Another Cu species may form during the reaction between water and CO.The catalytic decomposition of NO on the zeolite was observed at room temperature,indicating that the decomposition reaction may occur between two coordinated NO ligands of the same dinitrosyhc complex.Furthermore,the appearance of two series of NO adsorption bands reveals that copper ions existing at different cation sites may have different effect on the adsorption and decomposition of NO molecules.     

Studies on the Molecular Chain Conformation Stability of Aminated Konjac Glucomannan

Konjac glucomannan （KGM） was aminated by 2-chloroethyl-amine （CEA） as reagent so as to study the influence of concentration of CEA （based on the amount of KGM）, concentration of NaOH, reaction time and temperature on the extent of amination. And the molecular simulation technology was adopted to analyze the conformation stability of aminate （AKGM）. The results indicate that when the amount of CEA is higher, the extent of amination is higher. The optimum concentration of NaOH, reaction time and temperature are 10% NaOH, 70 ℃ and 45 rain, respectively. IR shows KGM is successfully aminated. The conformation of AKGM is in a random clew-like shape.     

酶催化光度法测定异丙肾上腺素

试验表明:在pH 9.5氨水-氯化铵缓冲介质中,牛血红蛋白对过氧化氢与酸性络蓝K的氧化还原反应的催化作用因异丙肾上腺素的存在而被抑制,而且其抑制率与异丙肾上腺素的浓度在8.1×10~(-8)～1.2×10~(-5)mol·L~(-1)范围内呈线性关系,其检出限(3S/N)为2.2×10~(-9)mol·L~(-1)。据此,提出了一种简单而灵敏的测定异丙肾上腺素的酶催化光度法。此方法已用于盐酸异丙肾上腺素注射液中异丙肾上腺素含量的测定,并以此样品为基体用标准加入法作回收试验,测得回收率在92.8%～105.4%之间,测定值的相对标准偏差(n=5)在2.6%～5.8%之间。     

钴(Ⅱ)、锰(Ⅱ)与4-吡啶甲醛缩4-氨基安替比林配合物的合成、晶体结构与磁性

以希夫碱衍生物4-氨基安替比林缩吡啶-4-甲醛为配体(L),采用溶剂热合成法,成功合成了2个Schiff碱Co(Ⅱ)配合物[CoLCl₂](1)、Mn(Ⅱ)配合物[MnLCl₂](2),通过元素分析、红外光谱IR、XRD、TG和磁性分析等测试手段对2个配合物进行表征,并用X-射线单晶衍射测得Co(Ⅱ)、Mn(Ⅱ)配合物的晶体结构。单晶结构表明,配合物1的晶体属于单斜晶系,空间群为Cc;配合物2的晶体属于三斜晶系,空间群为P1。配合物1是以Co(Ⅱ)为中心的扭曲四面体构型,配合物2是以Mn(Ⅱ)为中心的扭曲八面体构型。     

Effect of Plasma Treatment on the Structures and Properties of Konjac Glucomannan Film

To understand the effect of plasma treatment on the Konjac glucomannan film, the nitrogen plasma was injected into the film by ion beam injection machine in this study. The structures and properties of Konjac glucomannan film after plasma treatment were analyzed by Infrared spectroscopy, Raman spectrum, X-ray, ect. The result showed that nitrogen groups appeared in the KGM molecular chain and part of this chain fractured, and the number of hydrogen bonds increased after the treatment of plasma. The form of KGM molecule remained amorphous non-crystalline state, but the crystalline region was increased and became more ordered. The mechanical property of tensile strength and breaking elongation was improved, while the WVP was decreased. The nitrogen groups were grafted on the KGM molecular chain after plasma treatment, which led to the improvement of the properties of KGM film.     

气体在纳孔分子材料中吸附的理论模拟研究进展

纳孔分子材料是由孤立分子通过非共价相互作用堆积形成的具有纳微孔道结构的材料.和传统共价网络孔材料相比,纳孔分子材料具有独特的溶解性,并兼具气体存储与分离,限域反应和催化等方面的潜在应用,已成为当前研究的新热点.通过着眼于新型纳孔分子材料的设计,对相关理论研究进行了综合评述,主要包括以下3个方面:(1)无论是气体吸附还是催化反应,纳孔分子材料的晶体结构预测都是先决条件,只有在纳孔分子材料的晶体结构得到准确预测的前提下,才能够定向、准确、系统地对其进行设计;(2)气体在纳孔分子材料中吸附的分子动力学研究有助于深刻理解气体吸附的微观传输扩散机制;(3)气体在纳孔分子材料中吸附的巨正则蒙特卡洛模拟有利于对设计材料的吸附性能进行直接预测,得到可以直接与实验吸附量、吸附热等信息进行比较的结果.最后,简述了理论设计新型纳孔分子材料存在的问题以及未来发展前景.     

乙烯齐聚制α-烯烃反应体系的热力学研究

利用Benson基团贡献法计算了乙烯齐聚制α-烯烃反应各物质的标准摩尔生成焓、标准摩尔熵和摩尔定压热容,在298～700 K温度范围内对乙烯齐聚制α-烯烃反应体系的反应热、吉布斯自由能以及反应平衡常数进行了详尽的计算,分析了不同反应步骤的热力学平衡与限度,对不同反应发生的热力学可能性与顺序进行了判断,考察了反应温度和压力对乙烯齐聚制α-烯烃反应化学平衡的影响,确定了乙烯齐聚制α-烯烃反应体系适宜的工艺条件.结果表明:乙烯齐聚制α-烯烃反应为放热反应;从热力学上看,温度低于546 K时,乙烯齐聚生成直链α-烯烃反应为自发过程,且比α-烯烃异构化和烯烃歧化反应更容易进行;低温、高压有利于乙烯齐聚制α-烯烃反应的进行;乙烯齐聚制α-烯烃反应体系适宜的工艺条件为温度323～473 K,压力5～20 MPa,且在SHOP法的工艺条件下(温度363 K,压力10.3 MPa),乙烯齐聚生成直链α-烯烃反应的热力学平衡转化率接近于100%.