HMS和NaY固载酒石酸钛配合物的研究

利用化学键合和“瓶中造船”方法,成功地将酒石酸钛配合物接枝到HMS(heragonal mesoporous silicas)上或包络合于微孔NaY内.FT-IR表征表明酒石酸钛在HMS上是通过与载体表面羟基发生交换作用而被固载的;在NaY载体上则是通过包络合被封装在载体的超笼内.UV-Vis可见漫反射表征表明两类固载型催化剂有着相似的钛配位环境.在催化肉桂醇环氧化反应中,HMS键合型催化剂的反应转化率比NaY包络型催化剂的高;但后者在环氧化选择性上要高于前者.回收样品的重复使用实验结果表明,两类固载型催化剂在重复使用过程中均存在不同程度的失活.     

北半球环流系统季节内及年际以上振荡信号的信息传输

利用NCEP/NCAR月平均高度场再分析资料,分别提取季节内和年际以上振荡的基本特征和形式,运用信息传输理论分析这两种振荡信号的信息在低纬度与中高纬度间的传输.发现季节内振荡信号信息损失率较年际以上的偏大,且在特定地区这两种振荡信号的信息具有反向传输的特征;空间传输的水平分布上,两种振荡信号均表现为纬向上低纬度信息损失率大且海陆分布差异显著;空间传输的垂直分布上,年际以上振荡信号的低纬度高空信息损失率较大,中高纬度从对流层至平流层底信息损失率都较小,而季节内振荡信号则是低空信息损失率大,高空信息损失率小. 关键词： 滤波 高度场 信息损失率     

Reactions of a gold(I) thiolate complex [Au(Tab)(2)](2)(PF(6))(2) (Tab = 4-(trimethylammonio)benzenethiolate) with diphosphine ligands

Reactions of a gold(i) thiolate complex [Au(Tab)(2)](2)(PF(6))(2) (Tab = 4-(trimethylammonio)benzenethiolate) with equimolar 1,2-bis(diphenylphosphine)ethane (dppe), 1,3-bis-(diphenylphosphine)propane (dppp) or 1,4-bis-(diphenylphosphine)butane (dppb) in MeOH-DMF-CH(2)Cl(2) gave rise to three polymeric complexes [Au(2)(Tab)(2)(dppe)](2)(PF(6))(4)·2MeOH (1·2MeOH), [Au(2)(Tab)(2)(dppp)]Cl(2)·0.5MeOH·4H(2)O (2·0.5MeOH·4H(2)O), and [Au(4)(μ-Tab)(2)(Tab)(2)(dppb)](PF(6))(4)·4DMF (3·4DMF), respectively. Analogous reaction of 1 with dppb in DMF/C(2)H(4)Cl(2) produced one tetranuclear complex [Au(2)(μ-Tab)(Tab)(2)](2)Cl(4)·2DMF·4H(2)O (4·2DMF·4H(2)O). Complexes 1-4 were characterized by elemental analysis, IR spectra, UV-vis spectra, (1)H and (31)P{(1)H} NMR and single crystal X-ray analysis. Compounds 1 and 2 consist of [Au(Tab)](2) dimeric fragments that are bridged by dppe or dppp ligands to form a 1D linear chain extending along the a axis. For 3, each [Au(4)(Tab)(2)(μ-Tab)(2)] fragment is linked by a pair of dppb ligands to afford another 1D chain extending along the c axis. For 4, the four [Au(Tab)](+) fragments are linked by two Au-Au bonds and two doubly bridging Tab ligands to form a {[Au(Tab)](4)(μ-Tab)(2)} chair-like cyclohexane structure. Hydrogen-bonding interactions in 2 and 4 lead to the formation of interesting 2D hydrogen-bonded networks. The luminescent properties of 1-4 in solid state were also investigated.     

缓变下垫面对浅水方程的动力学订正

讨论了当下垫面随时间缓慢变化时浅水方程的形式. 从控制大气运动的连续性方程和动量方程出发, 将下垫面的缓慢变化作为一个小量叠加到固有下垫面函数上, 利用大气的上下边界条件, 得到改进的浅水方程. 在改进的浅水方程中, 由缓变局部水平体积散度, 订正了局部水平体积散度和流体局部厚度变化之间的平衡, 在此基础上得到包含下垫面缓变的涡度方程.     

Synthesis and Crystal Structure of (9S)-2′-O-Benzoyl-9,11-[carbonylbis(oxy)]-9-deoxo-5-O-(β-D-desosaminyl)-12,21-anhydro-9-hydroxy-erythronolide A

The title compound (9S)-2′-O-benzoyl-9,11-[carbonylbis(oxy)]-9-deoxo-5-O-(-D-desosaminyl)-12,21-anhydro-9-hydroxyerythronolide A 1 was synthesized. The crystal structure of the acetone solvate of 1, C37H55NO11·C3H6O, was determined by single-crystal X-ray diffraction analysis. It belongs to monoclinic system, space group P21 with a = 14.4691(10), b = 8.2626(6), c = 17.5990(11) , β = 94.167(1)°, V = 2098.4(2)3, Mr = 748, Z = 2, Dc = 1.184 g/cm3, μ = 0.087 mm-1, F(000) = 808, S = 1.026, R = 0.0542 and wR = 0.1322 for 3331 observed reflections (I > 2σ(I)). In the solid state, molecules of 1 are linked into spirals along the b axis by O(25)- H(25)···O(29) intermolecular hydrogen bond.     

噪声对滑动移除近似熵的影响

受外强迫和仪器本身的测量误差等因素的影响, 观测数据中经常包含噪声和扰动等一些虚假的信息. 针对这一问题, 本文研究了各种不同噪声对滑动移除近似熵的影响. 研究结果表明, 滑动移除近似熵的检测结果受尖峰噪声和高斯白噪声的影响较小, 意味着其具有很强的抗噪能力, 这为该方法在实际观测资料中的广泛应用提供了坚实的实验基础.     

The stability of Bose--Einstein condensates in a two-dimensional shallow trap

The stability of Bose--Einstein condensates (BECs) loaded into a two-dimensional shallow harmonic potential well is studied. By using the variational method, the ground state properties for interacting BECs in the shallow trap are discussed. It is shown that the possible stable bound state can exist. The depth of the shallow well plays an important role in stabilizing the BECs. The stability of BECs in the shallow trap with the periodic modulating of atom interaction by using the Feshbach resonance is also discussed. The results show that the collapse and diffusion of BECs in a shallow trap can be controlled by the temporal modulation of the scattering length.     

Epoxidation of styrene catalyzed by manganese (III) porphyrins supported on chloromethylated polystyrene resin bearing crown ether groups,

Metalloporphyrins and crown ether groups were simultaneously supported on chloromethylated polystyrene resin to produce a series of polymer-supported catalysts. The synthesis of these catalysts has been studied. The influence of pH, concentrations of NaOCl and phase transfer catalysts on the epoxidation of styrene catalyzed by these catalysts has also been investigated. The experimental results show that manganese(III) porphyrin bound to chloromethylated polystyrene which bears crown ether groups is effective catalysts for the epoxidation of styrene by sodium hypochlorite. The introduction of crown ether groups increases the catalytic efficiency of supported metalloporphyrins. The kinetics of epoxidation catalyzed by supported manganese(III) porphyrins obeys Michaelis-Menten equation—the characteristic of enzyme-driven reaction.     

Use of Artificial Neural Networks to Determine the Gas Chromatographic Retention Index data of Alkylbenzenes on Squalane (SQ)

Quantitative structure-property relationships (QSARs) quantify the connection between the structure and properties of molecules and allow the prediction of properties from structural parameters. Models of relationships between structure and retention index of aLkylbenzenes were constructed by means of a multilayer neural network using Extended Delta-Bar-Delta (EDBD) algorithms1'1. The 78 group data (taken from reference) belong to 33 alkylbenzenes under different temperatures on SQ. Considered,each of them has a same part of phenyl, each was uniquely presented by a set of numeric codes of 6 numbers depending on its substituents. Some examples were shown in Table 1. A set of six numbers and the temperature were used as input parameters to predict the retention indexes. The data were randomly divided into two sets:training set (60 members) and testing set (18 members) The structures of networks and the learning times were optimized. The best structure of network is 7-4-1 and the optimum learning times is about 750 epochs.     

Synthesis and Structure of { (Tab-Tab) [Ag2(μ-Cl)4]·2MeCN}n (Tab = 4-(Trimethylammonio)benzenethiolate)

In the presence of Et4NCl?H2O,reaction of AgCl with TabHPF6 in MeCN afforded the title complex {(Tab-Tab)[Ag2(μ-Cl)4]·2MeCN}n 1.1 crystallizes in the orthorhombic space group Pbcn with a=16.782(3),b=6.8358(14),c=26.194(5) ,V=3004.9(10) 3,Z=8,μ= 1.817 mm-1,Dc=1.711 g/cm3,T=223 K,C11H16AgCl2N2S,Mr=387.10,F(000)=1544,S=1.160,R=0.0528 and wR=0.0896 for 2732 observed reflections with I > 2σ(I).1 contains a 1D linear [Ag2Cl4]n2n-chain coupled with the [Tab-Tab]2+ dications.Intermolecular hydrogen bonding interac-tions between the protons of methyl groups from the Tab-Tab dications and the chlorides result in the formation of a 2D hydrogen-bonded network.