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991.
Rodrigo S. Corrêa Felipe T. Martins Javier Ellena Marcelo H. dos Santos Antonio C. Doriguetto 《Acta Crystallographica. Section C, Structural Chemistry》2008,64(7):o395-o397
The asymmetric unit of the title compound, C6H9N2OS2+·HSO4−·H2O, contains a heterocyclic cation, a hydrogen sulfate anion and a water molecule. There are strong hydrogen bonds between the hydrogen sulfate anions and water molecules, forming an infinite chain along the [010] direction, from which the cations are pendent. The steric, electronic and geometric features are compared with those of similar compounds. In this way, structural relationships are stated in terms of the influence of the sulfate group on the protonation of the heterocycle and on the tautomeric equilibrium in the solid state. 相似文献
992.
de Oliveira CS Falcão-Silva Vdos S Siqueira JP Harding DP Lira BF Lorenzo JG Barbosa-Filho JM de Athayde-Filho PF 《Molecules (Basel, Switzerland)》2011,16(3):2023-2031
Two salts of the mesoionic compounds 1,4-diphenyl-5-(5-nitro-2-furanyl)-1,3,4-thiadiazolium-2-thiol chloride (MC-1) and 4-phenyl-5-(5-nitro-2-furanyl)-1,3,4-thiadiazolium-2-phenylamine chloride (MC-2) were synthesized utilizing 1,4-diphenyl-thiosemicarbazide and 5-nitro-2-furoyl chloride as starting materials. Their structures were characterized by IR, 1H-NMR, 13C-NMR and elemental analysis. These compounds were analyzed for their influence on the effectiveness of norfloxacin, tetracycline, and erythromycin (standard antibiotics) against resistant strains of Staphylococcus aureus. MC-1 and MC-2, at sub-inhibitory concentrations of 16 μg/mL, favourably modulated the antibiotic activity of tetracycline by 16- and 32-fold, respectively (MIC), and that of erythromycin by 4-fold. 相似文献
993.
M. Enriqueta Díaz de Vivar Sergio Baggio Andrs Ibaez Ricardo Baggio 《Acta Crystallographica. Section C, Structural Chemistry》2004,60(9):m451-m453
In the title complex of zinc(II) with 3,4,7,8‐tetramethyl‐1,10‐phenanthroline (tmph), viz. [Zn(C16H16N2)(H2O)4](S2O3), the metal atom has a monomeric octahedral ZnN2O4 complex environment comprising two N‐atom donors from the tmph group and four aqua O‐atom donors. The complex cation is connected to four thiosulfate anions through a compact hydrogen‐bonding network involving all coordinated aqua H‐atom donors and all the outer acceptors (O and S) of the anion. 相似文献
994.
Dina L. Kinoshita Luiz G. Ferreira Manoel L. De Siqueira 《International journal of quantum chemistry》1985,28(1):85-101
This is the third paper on the cellular method for polyatomic systems. We show how to deal with nonspherical Coulomb potentials. We also show how to modify the variational expression for the energy eigenvalues so as to obtain a faster convergence in the angular momentum series for the wavefunctions. We apply both techniques to the self-consistent calculation of SF6. Contrary to what we obtained in CH4 and SiH4, the cellular method cannot yield the correct equilibrium interatomic distance in the present case. The calculated ionization potentials are in the correct order but are all shifted by 2–3 eV. This shift is attributed to the wrong expression for exchange correlation. 相似文献
995.
The Hiyama couplings of both α-silylenoates and α-silylenamides are described. These sensitive substrate classes require particularly specific conditions, employing both appropriate silicon-based species and a silver additive to realize high yields of the coupling products. Regioselective platinum-catalyzed hydrosilylations provide a direct and convenient entry into these stereodefined trisubstituted alkenes. 相似文献
996.
José Roberto dos Santos Politi Paulo Roberto Rodrigues de Matos Maria José Araújo Sales 《Journal of Thermal Analysis and Calorimetry》2013,111(2):1437-1442
Demand for lubricating oils is increasing in the growing Brazilian economy. The use of vegetable bases in exchange of minerals can bring socio-economic and environmental benefits for Brazil. The purpose of this study is to compare the thermal and oxidative stability of vegetable oils related to the bases commonly used as lubricants. In this study, thermogravimetric analysis of castor oil, cotton oil, macauba’s almond oil, passion oil, paraffinic mineral oil, naphthenic oil (NH-140) and synthetic oil (Etro) was performed in inert and oxidative atmosphere to study the thermal and oxidative degradation of the vegetable oils related to the most common lubricants’ oils base. These oils’ oxidation stability were determined by standard procedures (ISO 6886). The use of mineral oil’s additives in these vegetable oils was tested to verify the viability of these additives to improve the oxidative stability of the vegetable oils. The castor oil and the cotton oil presented results of thermal analysis similar to the mineral and synthetic bases values. The castor oil was the only vegetable oil that showed a great oxidative stability. All other vegetable oils had their oxidative stability significantly increased by the additives. 相似文献
997.
This paper describes the development and evaluation of a sequential injection method to automate the determination of methyl parathion by square wave adsorptive cathodic stripping voltammetry exploiting the concept of monosegmented flow analysis to perform in-line sample conditioning and standard addition. Accumulation and stripping steps are made in the sample medium conditioned with 40 mmol L−1 Britton-Robinson buffer (pH 10) in 0.25 mol L−1 NaNO3. The homogenized mixture is injected at a flow rate of 10 μL s−1 toward the flow cell, which is adapted to the capillary of a hanging drop mercury electrode. After a suitable deposition time, the flow is stopped and the potential is scanned from −0.3 to −1.0 V versus Ag/AgCl at frequency of 250 Hz and pulse height of 25 mV. The linear dynamic range is observed for methyl parathion concentrations between 0.010 and 0.50 mg L−1, with detection and quantification limits of 2 and 7 μg L−1, respectively. The sampling throughput is 25 h−1 if the in line standard addition and sample conditioning protocols are followed, but this frequency can be increased up to 61 h−1 if the sample is conditioned off-line and quantified using an external calibration curve. The method was applied for determination of methyl parathion in spiked water samples and the accuracy was evaluated either by comparison to high performance liquid chromatography with UV detection, or by the recovery percentages. Although no evidences of statistically significant differences were observed between the expected and obtained concentrations, because of the susceptibility of the method to interference by other pesticides (e.g., parathion, dichlorvos) and natural organic matter (e.g., fulvic and humic acids), isolation of the analyte may be required when more complex sample matrices are encountered. 相似文献
998.
Hugo D. Fernández Sare B. Miara M.L. Santos 《Mathematical Methods in the Applied Sciences》2012,35(18):2157-2165
In this paper, we consider a piezoelectric dissipative system in which a dissipation term is given through the mechanical part of the stress tensor. The abstract Cauchy problem associated to this system generates a semigroup of linear operators. We establish the analyticity of this semigroup that, in turn, implies the exponential decay of the corresponding energy and the strong regularity of the solutions. Copyright © 2012 John Wiley & Sons, Ltd. 相似文献
999.
Vicenţiu D. Rădulescu Gelson C. G. dos Santos Leandro S. Tavares 《Mathematische Nachrichten》2023,296(6):2555-2574
This paper is concerned with the existence and multiplicity of solutions for a class of problems involving the Φ-Laplacian operator with general assumptions on the nonlinearities, which include both semipositone cases and critical concave convex problems. The research is based on the subsupersolution technique combined with a truncation argument and an application of the Mountain Pass Theorem. The results in this paper improve and complement some recent contributions to this field. 相似文献
1000.
“Click” Chemistry Mildly Stabilizes Bifunctional Gold Nanoparticles for Sensing and Catalysis 下载免费PDF全文
Na Li Dr. Pengxiang Zhao Dr. Na Liu María Echeverria Dr. Sergio Moya Dr. Lionel Salmon Dr. Jaime Ruiz Prof. Dr. Didier Astruc 《Chemistry (Weinheim an der Bergstrasse, Germany)》2014,20(27):8363-8369
A large family of bifunctional 1,2,3‐triazole derivatives that contain both a polyethylene glycol (PEG) chain and another functional fragment (e.g., a polymer, dendron, alcohol, carboxylic acid, allyl, fluorescence dye, redox‐robust metal complex, or a β‐cyclodextrin unit) has been synthesized by facile “click” chemistry and mildly coordinated to nanogold particles, thus providing stable water‐soluble gold nanoparticles (AuNPs) in the size range 3.0–11.2 nm with various properties and applications. In particular, the sensing properties of these AuNPs are illustrated through the detection of an analogue of a warfare agent (i.e., sulfur mustard) by means of a fluorescence “turn‐on” assay, and the catalytic activity of the smallest triazole–AuNPs (core of 3.0 nm) is excellent for the reduction of 4‐nitrophenol in water. 相似文献