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91.
Mohammad Hossein Keshavarz Somayeh Moradi Bahman Ebrahimi Saatluo Hadi Rahimi Ali Reza Madram 《Journal of Thermal Analysis and Calorimetry》2013,112(3):1453-1463
A novel general method is introduced to predict deflagration temperature of organic energetic compounds containing at least –NNO2, –ONO2, or –CNO2 groups. Deflagration temperature is an important safety parameter in working with dangerous energetic compounds and their environmental problems. It is shown that the contribution of some molecular structure parameters can be used to interpret thermal decomposition of an energetic compound. For 86 energetic materials (corresponding to 102 measured values) with different molecular structures, the new correlation has the root mean square (rms) and the average deviations of 23.8 and 19.0 K, respectively. The new method is also tested for some energetic compounds with complex molecular structures, e.g., two new organic energetic molecules N,N′-bis(1,2,4-triazol-3yl)-4,4′-diamino-2,2′,3,3′,5,5′,6,6′-octanitroazobenzene (BTDAONAB) and 2,4,6-trinitrophloroglucinol. 相似文献
92.
Mahdi Tohidian Seyed Reza Ghaffarian Seyed Emadodin Shakeri Erfan Dashtimoghadam Mohammad Mahdi Hasani-Sadrabadi 《Journal of Solid State Electrochemistry》2013,17(8):2123-2137
Nanocomposite membranes based on polyelectrolyte complex (PEC) of chitosan/phosphotungstic acid (PWA) and different types of montmorillonite (MMT) were prepared as alternative membranes to Nafion for direct methanol fuel cell (DMFC) applications. Fourier transform infrared spectroscopy (FTIR) revealed an electrostatically fixed PWA within the PEC membranes, which avoids a decrease in proton conductivity at practical condition. Various amounts of pristine as well as organically modified MMT (OMMT) (MMT: Cloisite Na, OMMT: Cloisite 15A, and Cloisite 30B) were introduced to the PEC membranes to decrease in methanol permeability and, thus, enhance efficiency and power density of the cells. X-ray diffraction patterns of the nanocomposite membranes proved that MMT (or OMMT) layers were exfoliated in the membranes at loading weights of lower than 3 wt.%. Moreover, the proton conductivity and the methanol permeability as well as the water uptake behavior of the manufactured nanocomposite membranes were studied. According to the selectivity parameter, ratio of proton conductivity to methanol permeability, the PEC/2 wt.% MMT 30B was identified as the optimum composition. The DMFC performance tests were carried out at 70 °C and 5 M methanol feed and the optimum membrane showed higher maximum power density as well as acceptable durability compared to Nafion 117. The obtained results indicated that owing to the relatively high selectivity and power density, the optimum nanocomposite membrane could be considered as a promising polyelectrolyte membrane (PEM) for DMFC applications. 相似文献
93.
In this work, a voltammetric method has been developed for the simultaneous determination of captopril (CPT) and hydrochlorothiazide (HCT) in pharmaceutical combinations and clinical samples using a graphene/ferrocene composite carbon paste (GR/Fc/CP) electrode. The electrochemical behaviors of CPT and HCT were individually and simultaneously investigated at the surface of the GR/Fc/CP electrode. In differential pulse voltammetric (DPV) mode and under optimized experimental conditions, CPT and HCT gave linear responses over the concentration ranges 1.0–430 µM and 0.5–390 µM (r2>0.99), respectively. The prepared electrode could be used for simultaneous determination of CPT and HCT in some real samples. 相似文献
94.
Elaheh Esmaeili Ali Morad Rashidi Yadollah Mortazavi Abbas Ali Khodadadi Mehdi Rashidzadeh 《天然气化学杂志》2013,(5):717-725
In the present study,CNFs,ZnO and Al2O3 were deposited on the SMFs panels to investigate the deactivation mechanism of Pd-based catalysts in selective acetylene hydrogenation reaction.The examined supports were characterized by SEM,NH3-TPD and N2adsorption-desorption isotherms to indicate their intrinsic characteristics.Furthermore,in order to understand the mechanism of deactivation,the resulted green oil was characterized using FTIR and SIM DIS.FTIR results confirmed the presence of more unsaturated constituents and then,more branched hydrocarbons formed upon the reaction over alumina-supported catalyst in comparison with the ones supported on CNFs and ZnO,which in turn,could block the pores mouths.Besides the limited hydrogen transfer,N2 adsorption-desorption isotherms results supported that the lowest pore diameters of Al2O3/SMFs close to the surface led to fast deactivation,compared with the other catalysts,especially at higher temperatures. 相似文献
95.
Chemical functionalization of C60 fullerene with one to six carbene (CH2) molecule(s) has been investigated using density functional theory. We have found that the reaction is regioselective so that a CH2 molecule prefers to be adsorbed atop a C–C bond which is shared between two hexagonal rings of the C60, releasing energy of ?3.95 eV. Singly occupied molecular orbital (SOMO) of the CH2 interacts with LUMO of the C60 via a [2 + 1] cycloaddition reaction. Energy of the reaction and work function of the system are decreased by increasing the number of adsorbed CH2 molecules. The HOMO/LUMO energy gap of C60 is slightly changed and the electron emission from its surface is facilitated upon the functionalization. 相似文献
96.
Mehdi Mousavi-Kamazani Masoud Salavati-Niasari Majid Ramezani 《Journal of Cluster Science》2013,24(3):927-934
This study reports on the synthesis of Cu2S nanoparticles via an ultrasonic method by employing Na2SO3 as a reducing agent. Morphology, structure, and composition of the obtained products were characterized by X-ray diffraction, energy dispersive X-ray analysis, scanning electron microscope and photoluminescence spectroscopy. The effects of time and power of irradiation were studied. 相似文献
97.
Mohammad Reza Hadjmohammadi S. Saman S. J. Nazari 《Journal of separation science》2013,36(23):3667-3672
The simultaneous isocratic separation of a mixture of five phenolic acids and four flavonoids (two important groups of natural polyphenolic compounds with very different polarities) was investigated in three different RPLC modes using a hydro‐organic mobile phase, and mobile phases containing SDS at concentrations below and above the critical micellar concentration (submicellar LC and micellar LC (MLC), respectively). In the hydro‐organic mode, methanol and acetonitrile; in the submicellar mode methanol; and in the micellar mode, methanol and 1‐propanol were examined individually as organic modifiers. Regarding the other modes, MLC provided more appropriate resolutions and analysis time and was preferred for the separation of the selected compounds. Optimization of separation in MLC was performed using an interpretative approach for each alcohol. In this way, the retention of phenolic acids and flavonoids were modeled using the retention factors obtained from five different mobile phases, then the Pareto optimality method was applied to find the best compatibility between analysis time and quality of separation. The results of this study showed some promising advantages of MLC for the simultaneous separation of phenolic acids and flavonoids, including low consumption of organic solvent, good resolution, short analysis time, and no requirement of gradient elution. 相似文献
98.
Mehdi Amirnasr Mahdieh Rasouli Kurt Mereiter 《Journal of the Iranian Chemical Society》2013,10(2):275-282
Two new cobalt(III) complexes of the hexadentate ligand [1,4-bis[o-(pyridine-2-carboxamidophenyl)]-1,4-dithiobutane] (H2bpctb) with N4S2 donor set atoms have been synthesized. A reaction of Co(CH3COO)2·4H2O with (H2bpctb) leads to the formation of [CoIII(bpctb)]PF6 (1) having a CoN2(pyridine)N′2(amide)S2(thioether) coordination by symmetric bpctb2? ligand. A similar reaction under slightly different conditions, however, gives [CoIII(L a )(L b )] (2), resulting from a C–S bond cleavage reaction triggered by an acetate ion as a base, having CoN2(pyridine)N′2(amide)S(thioether)S′(thiolate) coordination. These two Co(III) complexes have been characterized by elemental analyses and spectroscopic methods, and the crystal and molecular structures of [CoIII(bpctb)]PF6 (1) in the form of the solvate (1·MeOH·H2O) and of [CoIII(L a )(L b )] (2) have been determined by X-ray crystallography. The Co atoms of both complexes exhibit distorted octahedral geometry. The electrochemical investigation of [Co(bpctb)]PF6·MeOH·H2O (1·MeOH·H2O) and [CoIII(L a )(L b )] (2) by cyclic voltammetry reveals a reversible CoIII–CoII redox process at E 1/2 = ?0.32 V (ΔE p = 80 mV); for 1, and E 1/2 = ?0. 87 V (ΔE p = 70 mV) for 2. 相似文献
99.
Mohammad Ali Taher Maryam Fayazi Behjat Pooramiri Masoud Ghanei-Motlagh Ali Dorehgiraee 《Journal of the Iranian Chemical Society》2013,10(1):151-159
A new solvent polymeric membrane (PME) and coated graphite (CGE) electrodes based on 3-amino-2-mercapto-3H-quinazolin-4-one as a suitable carrier for La(III) ion are described. The sensors exhibited a Nernstian response for La(III) ion over a wide concentration range (3.0 × 10?7 to 1.0 × 10?1 M for PME and 1.0 × 10?7 to 1.0 × 10?1 M for CGE) with a slope of 20.1 ± 0.3 (PME) and 23.4 ± 0.4 (CGE) mV decade?1. The lower detection limits by PME and CGE were 2.0 × 10?7 and 7.1 × 10?8 M, respectively. The potentiometric response of the proposed electrodes was independent of the pH of the test solution in the pH range 3.0–9.0 with a fast response time (<10 s). The applications of prepared sensors were demonstrated in the determination of lanthanum ions in spiked water sample and also utilized for indirect determination of fluoride content of two mouth wash preparation samples. 相似文献
100.
Mohammad Abbasi Mohammad Reza Mohammadizadeh Zeinab Khatoon Taghavi 《Journal of the Iranian Chemical Society》2013,10(2):201-205
An efficient and odorless synthesis of disulfides from alkyl halides using thiourea and elemental sulfur in the presence of sodium carbonate in wet polyethylene glycol (PEG 200) at 40 °C without contamination by higher polysulfides has been developed. This procedure was then extended to preparation of disulfides from alkyl tosylates at 70 °C. 相似文献