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111.
用三丁基氯化锡与戊二羧酸二钠以2:1摩尔比反应,合成了双(三丁基锡)戊二羧酸酯,并用元素分析、红外光谱、核磁共振氢谱及X-射线单晶衍射进行了表征和结构测定。X-射线单晶衍射法测定表明,化合物属单斜晶系,空间群为Cc,晶胞参数:a=13.984(3),b=16.164(3),c=16.894(3)A,β=107.457(3)°,V=3642.9(11)A3,Z=4,C29H60O4Sn2,Dc=1.251g/cm3,μ=1.394 mm-1,R=0.0500,wR=0.0874,F(000)=1416。晶体结构中存在2种化学环境不同的三角双锥构型的锡原子,由于配体中2个羧基在不同方向的交联作用,使化合物呈现三维立体骨架结构,并且在骨架结构中存在沿a、b、c轴3个方向伸展的规则的大环直孔道。 相似文献
112.
113.
Simulation of aerated lagoon using artificial neural networks and multivariate regression techniques
Karla Patricia Oliveira-Esquerre Aline C. da Costa Roy Edward Bruns Milton Mori 《Applied biochemistry and biotechnology》2003,106(1-3):437-449
The aim of this study was to develop an empirical model that provides accurate predictions of the biochemical oxygen demand
of the output stream from the aerated lagoon at International Paper of Brazil, one of the major pulp and paper plants in Brazil.
Predictive models were calculated from functional link neural networks (FLNNs), multiple linear regression, principal components
regression, and partial least-squares regression (PLSR). Improvement in FLNN modeling capability was observed when the data
were preprocessed using the PLSR technique. PLSR also proved to be a powerful linear regression technique for this problem,
which presents operational data limitations. 相似文献
114.
A novel coordination polymer [{Cd(hmbdc)(H2O)3}·2H2O]n (hmbdc=5-hydroxy- isophthalic acid) has been synthesized and characterized by elemental analysis, IR spectra and single-crystal X-ray diffraction. The crystal belongs to monoclinic, space group P21/c, with a=9.599(3), b=18.699(5), c=7.557(2) (A), β= 108.198(4)°, V=1288.6(6) (A)3, Z=4, Mr=382.60, Dc=1.972 g/cm3, F(000)=760, μ=1.740, the final R=0.0555 and wR=0.0995 for 1732 observed reflections with Ⅰ > 2σ(Ⅰ). The structural analysis shows that the intermolecular hydrogen bonds and π-π interactions result in a three-dimensional supramolecular framework. 相似文献
115.
J. P. Osleeb S. J. Ratick P. Buckley K. Lee M. Kuby 《Annals of Operations Research》1986,6(6):161-180
The formulation and use of a mixed integer mathematical programming location-allocation model, the Coal Logistics System (COLS), is presented in this study. COLS is used to evaluate the potential for reducing water-borne coal transportation costs, and concomitantly the costs of delivering coal to European markets. This cost reduction is accomplished through the use of supercolliers which would require the dredging of channels at selected ports or the use of offshore loading sites at East and Gulf Coast ports or both. The model developed and the analysis presented in this paper are intended to aid in the determination of the location and extent of these activities, and to indicate the size of the potential reduction in the costs of U.S. export coal. In order to be able to accommodate these deeper draft vessels at East and Gulf Coast ports, expensive improvements would need to be undertaken which may include the deepening of harbor channels to the depths required for 120 000 dead weight ton (dwt) or larger supercolliers. Since dredging requires large initial investments and has significant long-term maintenance costs, excess capacity could represent an inefficient use of both U.S. revenues and the ports' own funds. The use of offshore loading moorings to permit the topping off of supercolliers by self-unloading colliers at the deepwater sections of harbor channels has been proposed as a way of reducing trans-ocean transportation costs and avoiding the large investments and time delays associated with dredging activities. The Coal Logistics System was modified and extended to enable the evaluation of these two port improvement options to be undertaken in a consistent and realistic manner. 相似文献
116.
应用改良BP网络于多组分药物定量分析 总被引:5,自引:0,他引:5
BP网络自身学习速度慢的缺点,影响了其在多组分同时定量分析中的应用,为此,本文从误差函数、传递函数和网络参数等方面应用Fahllman和Cater等所提修改方案改了B P网络,并将其应用于甲硝唑、先锋霉素、氯纱和氨卞四组分混合药物的同时定量分析,实验证明,在不损害网络预测精度的前提下,学习速度有了较大的提高。 相似文献
117.
There are many organic pollutants in the environment, such as polychlorinated biphenyl, polycyclic aromatic hydrocarbons, dichlorodiphenyl-trichloroethane (DDT), and polychlorinated naphthalene. These organic pollutants are persistent,liposoluble and easily cumulated in organism; consequently, the potential toxicity will be high. Risk assessment of industrial chemicals is currently carried out using scanty experimental data, because many of these chemicals have very little or no test data. S… 相似文献
118.
IntroductionInthepastseveralyears ,considerableprogresshasbeenachievedincontrollingtheassemblyofindividualbuildingblocksintostructureswithspecifictopologiesandinterestingpropertiessuchasmolecularrecognition ,ionexchangeandselectiveguestinclusion .1 3 Itis… 相似文献
119.
WANG Jingping LI Jie & NIU Jingyang Institute of Molecular Crystal Engineering Institute of Chemistry Chemical Engineering Henan University Kaifeng China 《中国科学B辑(英文版)》2006,(5)
A two-dimensional network compound [Ce(DMF)4(H2O)][α-BW12O40]·H2O·(HDMA)2 (HDMA = protoned dimethylamine, DMF = N,N-dimethylformamide) was synthesized from α-H5BW12O40·nH2O, Ce(NO3)3·6H2O and DMF and characterized by IR, UV spectra and TG-DTA. The result of the X-ray single crystal diffraction indicates that the crystal is monoclinic, space group P21/n, with unit cell dimensional: a = 1.1983(3), b = 2.4216(5), c = 1.9517(4) nm, β = 92.91(3)°, Z = 4, R1 = 0.07710, wR2 = 0.1416. Structural analysis indicates that every [Ce(DMF)4(H2O)]3 building block is surrounded by three adjacent [α-BW12O40]5- polyanions, meanwhile, every [α-BW12O40]5- polyanion interconnects with three neighboring [Ce(DMF)4(H2O)]3 subunits, by making use of which two-dimensional network structure can be constructed. The result of thermogravimetric analysis manifests that the title compound has two-stage weight loss and the decomposition temperature of the title polyanionic framework is 560℃ . The electrochemical analysis shows the title polyanion has three-step redox processes in the pH = 4―7 media. 相似文献
120.
Clemens C. Freyhardt Michael Wiebcke Jürgen Felsche Günter Engelhardt 《Journal of inclusion phenomena and macrocyclic chemistry》1994,18(2):161-175
Single-crystal X-ray structure analyses of N(nPr)4[B5O6(OH)4][B(OH)3]2,1, and N(nBu)4 [B5O6(OH)4][B(OH)3]2,2, reveal that these materials are novel clathrates, the isotypic host structures of which are three-dimensional assemblies of hydrogen-bonded [B5O6(OH)4]– ionsand B(OH)3 molecules. The assembly of only the pentaborate anions is a distorted (i.e., along [102] elongated) fourconnected diamond-related network. The N(nPr)
4
+
and N(nBu)
4
+
ions are trapped within the complex three-dimensional channel systems of the host frameworks. Both1 and2 crystallize monoclinically with space groupP21/c andZ=4. The cell constants are:1:a=13.592(5),b=12.082(2),c=17.355(6) Å, =106.60(2)° (298K);2:a=13.874(3),b=12.585(1),c=17.588(4) Å, =107.04(1)° (238 K). The results obtained by both11B and13C MAS NMR spectroscopy are discussed. Thermogravimetric studies under a flowing inert-gas atmosphere suggest that water, stemming from polycondensation of the hydrous borate species, is released from the clathrates at ca. 443 K (1) and 398 K (2) before the decomposition of the organic cations starts at ca. 603 K (1) and 603 K (2).Author for correspondence.
Supplementary Data relating to this article are deposited with the British Library as supplementary publication No. SUP 82172 (82 pages). 相似文献