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171.
Yaping Tao Ligang Han Xiaofeng Li Yunxia Han Zhaojun Liu 《Journal of Physical Organic Chemistry》2015,28(11):703-711
The Fourier transform infrared spectroscopy and Fourier transform Raman spectra of phenylacetyl chloride were recorded and analyzed in the range 3500–400 and 3500–200 cm?1 at room temperature, respectively. In order to obtain the structural information and conformational stabilities, a potential energy surface scan for internal rotation was carried out at the B3LYP/6‐31G(d) level. The potential energy surface reveals that the title compound has two minimal conformers (A and B). The optimized geometries, structural parameters, stabilities, energies, thermodynamic parameters, vibrational wavenumbers, infrared intensities, and Raman activities for the two conformers (A and B) have been obtained by employing B3LYP and MP2 calculations with 6‐311++G (d, p) basis sets. The conformational energy difference between A and B is very small, indicating that the B conformer coexists with the A conformer. The detailed vibrational assignments of vibrational spectra of each conformer have been made on the basis of the potential energy distributions analysis. The highest occupied molecular orbital –lowest unoccupied molecular orbital energy gap and molecular electrostatic potential of the two conformers have been also calculated for comparison of their chemical activities. Copyright © 2015 John Wiley & Sons, Ltd. 相似文献
172.
Li Yong-Feng Zhang Jie-Qiu Qu Shao-Bo Wang Jia-Fu Zheng Lin Zhou Hang Xu Zhuo Zhang An-Xue 《中国物理 B》2015,24(1):14202-014202
In this paper,we show that circular polarization-keeping reflection can be achieved using reflective metasurfaces.The underlying physical mechanism of the polarization-keeping reflection is analyzed using a reflection matrix.A wideband circular polarization-keeping reflector is demonstrated using N-shaped resonators.Both the simulation and experiment results show that the polarization-keeping reflection can be achieved with a high efficiency larger than 98%over the frequency range from 9.2 GHz to 17.7 GHz for both incident left-and right-handed circularly polarized waves.Under oblique incidence,the bandwidth increases as the incident angle varies from 0°to 80°. Moreover,the co-polarization reflection is independent of the incident azimuth angles. 相似文献
173.
Frequency-locking and threshold current-lowering effects of a quantum cascade laser and an application in gas detection field
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In this paper,the frequency-locking and threshold current-lowering effects of a quantum cascade laser are studied and achieved.Combined with cavity-enhanced absorption spectroscopy,the noninvasive detection of H_2 with a prepared concentration of 500 ppm in multiple dissolved gases is performed and evaluated.The high frequency selectivity of 0.0051 cm~(-1) at an acquisition time of 1 s allows the sensitive detection of the(1-0) S(l) band of H_2 with a high accuracy of(96.53±0.29)%and shows that the detection limit to an absorption line of 4712.9046 cm~(-1) is approximately(17.26±0.63) ppm at an atmospheric pressure and a temperature of 20 ℃. 相似文献
174.
J. L. Li S. D. Zhu Z. F. Yin C. T. Qu Y. L. Wei 《Russian Journal of Electrochemistry》2014,50(9):838-845
CO2/H2S corrosion behavior of tubular steel SM 80SS have been investigated utilizing electrochemical measurement technology, weight loss test, scanning electron microscope (SEM) and X-ray diffraction (XRD). The results showed that temperature increased the corrosion rate and changed the corrosion mechanism of tubular steel SM 80SS. Cl? quickened the anodic dissolution and increased the corrosion rate of tubular steel SM 80SS. Furthermore, the addition of Ca2+ and Mg2+ resulted in the corrosion products changing from crystalline FeCO3 to amorphous Fe(Ca,Mg)(CO3)2 and serious corrosion under scale of tubular steel SM 80SS. 相似文献
175.
Hongqiang Qu Caihong Liu Weihong Wu Lingzhi Chen Jianzhong Xu 《Journal of Thermal Analysis and Calorimetry》2014,115(2):1081-1087
Flame-retarded poly(vinyl chloride) (PVC) materials have been prepared by using zinc ferrite (ZnFe2O4 (ZFO)) combined with magnesium hydroxide (Mg(OH)2 (MH)). The effects of these additives on the combustion and thermal degradation of PVC samples were studied using the limiting oxygen index test, the smoke density rating test, thermogravimetric–differential thermogravimetry, and the cone calorimeter test. The results showed that ZFO and MH were good synergists for improving the flame retardancy and smoke-suppressing of PVC/MH/ZFO blends. ZFO can significantly improve the maximum mass loss velocity in the first stage, and reduce the initial decomposition temperature and the decomposition range in the PVC/MH/ZFO blends. The char yield at 700 °C of flame-retarded PVC clearly decreased below theoretical values due to the cationic cracking reactions in the presence of ZFO. Furthermore, the PVC/10MH/10ZFO showed strong flame-retarding synergism since the decreased average heat release rate value. And the PVC/19MH/1ZFO presented a significant smoke-suppressing effect by the least average specific extinction area, peak smoke production rate, and total smoke produce. Moreover, the CO and CO2 production was increased because of a large amount of fragment of char residue in contact air in the presence of ZFO. 相似文献
176.
Highly Enantioselective Ring‐Opening Reactions of Aziridines with Indole and Its Application in the Building of C3‐Halogenated Pyrroloindolines
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Fengxia Han Dan Li Dr. Depeng Zhao Dr. Yiming Cao Yunxia Ma Weidong Kong Quantao Sun Prof. Dr. Rui Wang 《Chemistry (Weinheim an der Bergstrasse, Germany)》2014,20(50):16478-16483
A magnesium‐catalyzed asymmetric ring‐opening reaction of aziridine with indole has been realized by employing commercially available chiral ligands. Both of the enantiomers of the ring‐opening product could be obtained with good yields and a high level of enantioselectivity. The corresponding ring‐opening product could be further transformed to various types of enantioenriched C3‐halogenated‐pyrroloindolines. 相似文献
177.
Clickable Periodic Mesoporous Organosilicas: Synthesis,Click Reactions,and Adsorption of Antibiotics
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Dr. Jinsuo Gao Xueying Zhang Dr. Shutao Xu Prof. Feng Tan Prof. Xinyong Li Prof. Yaobin Zhang Prof. Zhenping Qu Prof. Xie Quan Dr. Jian Liu 《Chemistry (Weinheim an der Bergstrasse, Germany)》2014,20(7):1957-1963
Pharmaceutical antibiotics are not easily removed from water by conventional water‐treatment technologies and have been recognized as new emerging pollutants. Herein, we report the synthesis of clickable azido periodic mesoporous organosilicas (PMOs) and their use as adsorbents for the adsorption of antibiotics. Ethane‐bridged PMOs, functionalized with azido groups at different densities, were synthesized by the co‐condensation of 1,2‐bis(trimethoxysilyl)ethane (BTME) and 3‐azidopropyltrimethoxysilane (AzPTMS), in the presence of nonionic‐surfactant triblock‐copolymer P123, in an acidic medium. Four different alkynes were conjugated to azide‐terminated PMOs by means of an efficient click reaction. The clicked PMOs showed improved adsorption capacity (241 μg g?1) for antibiotics (ciprofloxacin hydrochloride) compared with azido‐functionalized PMOs because of the enhanced π–π stacking interactions. These results indicate that click reactions can introduce multifunctional groups onto PMOs, thus demonstrating the great potential of PMOs for environmental applications. 相似文献
178.
石墨烯由于其特殊的单原子层结构决定了其具有丰富而新奇的物理化学性质.在发现后的短短十年间,已在物理学、化学、材料科学与工程等领域产生了重要的影响,成为备受瞩目的国际研究前沿和热点.在石墨烯的研究和应用中,最重要的问题就是如何实现其可控制备,组装及功能化应用.近年来,包括本课题组在内的国内外很多研究人员一直在积极探索石墨烯及其功能复合物的制备及应用新途径,其中石墨烯与导电高分子聚吡咯(PPy)的复合是研究的重要内容之一,并且取得了一系列有价值的研究成果.本文对石墨烯/PPy复合结构的可控制备进行了系统的归纳与总结,也讨论了其在催化、驱动器、超级电容器和传感器等电化学应用领域的最新进展,并对相关领域的发展趋势做了展望. 相似文献
179.
A pyridoxal-based chemosensor was synthesized by reacting hydrazine hydrate and pyridoxal hydrochloride in ethanol and characterized by NMR and ESI-MS.The optical properties of the compound were investigated in a methanol:HEPES solution.The compound displayed selectivity for Cu2+,as evidenced by a colorless to yellow color change,which was characterized using UV–vis spectroscopy.The fluorescence of the compound can be quenched only by Cu2+,accompanying by a color change from blue to colorless.Furthermore,it can be used in bioimaging. 相似文献
180.
Hongyan Li Hong Ma Xinhong Wang Jin Gao Chen Chen Song Shi Minjie Qu Na Feng Jie Xu 《天然气化学杂志》2014,(6):742-746
Efficient catalytic oxidation of ethylbenzene to acetophenone was realized using the catalytic system of cobalt zeolitic imidazolate framework ZIF-67/N-hydroxyphthalimide (NHPI) under mild conditions. 95.2% conversion of ethylbenzene with 90.3% selectivity to acetophenone could be obtained at 373 K under 0.3 MPa 02 for 9 h. The results show that there exists synergetic effect between ZIF-67 and NHPI. 1-Phenylethyl hydroperoxide (PEHP) was generated via a radical process involving the hydrogen abstraction from ethylbenzene by phthalimide N-oxyl, and subsequently effectively decomposed to acetophenone by ZIF-67. 相似文献