Mo、W金属氧化物对CH4/CO2重整Ni基催化剂性能的影响

用XRD、XPS、元素分析、TEM和活性评价等方法研究过渡金属氧化物MoO3和WO3对SiO2负载的Ni基催化剂物理化学性质和CH4/CO2重整制合成气催化性能的影响.结果表明,在负载型的镍催化剂中,MoO3和WO3的添加一方面提高了Ni的核外电子密度,减弱了对CH4深度裂解积炭;另一方面使催化剂表面镍的相对浓度降低,结构上起到了隔离、分散金属颗粒的作用,氧的相对浓度升高,有效提高了催化剂的抗烧结和抗积炭能力,显示出较好的催化稳定性.     

活性炭纤维电极电解法处理墨绿B染料废水

将铁丝缠绕在活性炭纤维(简称ACF)上制成电极,并在阴极鼓入空气,用电解生成的Fenton试剂处理墨绿B染料模拟废水.研究了电压、pH值、温度、空气流量、支持电解质的浓度等因素对染料脱色率的影响.结果表明,pH值越低,温度越高,处理效果越好,气流量的改变对于处理效果影响不大.室温时处理浓度为50mg·L-1的活性染料墨绿B,在实验电压为11V,中性条件下,无水硫酸钠的浓度为20g·L-1,通入空气流量为60L·min-1时,处理60min,色度去除率达到95%左右.55℃时,电解30min色度去除率就达到96%,60min时达到100%.     

VPI—5分子筛热相变转化成ALPO4—8的研究

VPI-5是具有十八元环超大孔道的磷酸铝分子筛,在加热过程中,随着孔道中的水分子的脱除,其骨架结构转化成具有十四元环孔道的AlPO_4-8分子筛。采用XRD及骨架结构模型计算等方法研究了这一相变过程,并对相变机理进行了探讨。     

Synthesis of Novel Benzoylphenylurea Chitin Inhibitors From Chlorothalonil(Ⅱ)

IntroductionThe insecticidal activity of benzoylphenylurea( BPU ) analogues,discovered in the early1 970′s[1_ 4] ,is connected with the process ofmoult-ing and appears to affect the chitin synthesis of in-sects. The benzoylphenylurea class of insectgrowth regulators( IGRs) ,interfere with chitinsynthesis in target pests,causing death or abortivedevelopment and are considered to be the fourthgeneration of insecticides or novel materials for in-sect control.Benzoylphenylurea type insecticides…     

Structure and Two-photon Excited Blue Fluorescence of an Asymmetrical Substituted Stilbene

In common fluorescence process, molecular excitation is caused by the absorption of at least a single photon with shorter wavelength. When certain laser is used as the pump source, some compounds can be excited by simultaneous absorption of at least two photons and then the emission of up-converted fluorescence may occur. This process is called two-photon excited fluorescence (TPEF)1,2. Because of several advantages of TPEF, including intrinsic high three-dimensional resolution and the p…     

Improving the quality of 3D-QSAR by using flexible-ligand receptor models

To address the problems associated with molecular conformations and alignments in the 3D-QSAR studies, we have developed the Flexible Ligand - Atomic Receptor Model (FLARM) 2.0 method. The FLARM 2.0 method has three unique features as compared to other pseudoreceptor model methods: (1) the training ligands are flexibly optimized inside the receptors to achieve minimal docking energies; (2) the receptor atoms are spatially moveable in the process of genetic evolving in order to avoid improper initial receptor shapes; and (3) void receptor sites are specially favored in order to obtain open receptor models that allow large gaps. Advantages of an open model include less noise information, a smaller risk of overfitting, and ease of locating the key interaction sites. The latter two features, inherited from the previous FLARM 1.0 method, can improve the predictive ability of the 3D-QSAR models, while the first feature is newly implemented to relieve the uncertainty caused by improper conformation and alignment. Three FLARM 2.0 case studies were performed, and the results show that FLARM 2.0 models are highly predictive and robust. FLARM 2.0 pseudoreceptor models can correspond well with the pharmacophore models and/or the binding sites of the real protein receptors.     

Investigation of Aconitine-type Alkaloids from Processed Tuber of Aconitum carmiechaeli by HPLC-ESI-MS/MS~n

Introduction Aconitine-type alkaloids isolated from the roots of Aconitum carmiechaeli show a potential toxicity and a broad spectrum of bioactivity[1-4].On the basis of the C8-substituent of C19-diterpenoid skeleton,aconitine-type alkaloids can be divided into diester-diterpenoid alkaloids(DDAs),monoester-diterpenoid alkaloids(MDAs),and lipo-alkaloids(Fig.1).     

手性双氨基醇-Et2Zn催化的不对称直接羟醛缩合反应

以1,3-二溴丙酮和(2'S)-(二苯基羟甲基)-四氢吡咯为原料,合成了两种新型手性氨基醇1,3-双[(2'S)-(二苯基羟甲基)-1-四氢吡咯基]丙酮(3)和1,3-双[(2'S)-(二苯基羟甲基)-1-四氢吡咯基]-2-丙醇(4),总产率分别为39%和35%.手性双氨基醇3-/4-Et2Zn可催化未修饰醛、酮的不对称直接羟醛缩合反应,对映体过量最高9%.     

弱酸树脂D113对S-腺苷-L-蛋氨酸的交换行为及分离应用研究

考察了S-腺苷-L-蛋氨酸 (S-adenosyl-L-methionine, SAM) 在弱酸树脂争光D113上的静态吸附及分离行为,利用Langmuir等温式对平衡等温线进行了拟合,实验表明,随着pH的提高,平衡交换量增加,提高温度和SAM的初始浓度在一定程度上能促进内扩散过程,利用D113树脂在f 1.7×30.0cm小型柱上从酵母提取液中分离SAM的得率为90%以上,纯度达87%以上。     

Solid Phase Synthesis of 4H-Pyrimido[2,1-b] Benzothiazol-4-ones from Resin-Bound Cyclic Malonic Ester

The solid phase synthesis of 4H-pyrimido[2,1-6] benzothizaol-4-ones has been reported.