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101.
Yong‐Min Lee Yoon‐Bo Shim Seung Jae Lee Sung Kwon Kang Sung‐Nak Choi 《Acta Crystallographica. Section C, Structural Chemistry》2002,58(12):o733-o734
The structure of the title compound, C15H27N2+·ClO4?, consists of a monoprotonated sparteinium cation and a perchlorate anion. The two tertiary N atoms of the cation, one perchlorate O atom and a H atom form a bifurcated hydrogen bond, the four hydrogen‐bonding atoms being nearly in the same plane. 相似文献
102.
The vertical ionization potentials of difluoramine are calculated by perturbation corrections to Koopmans' theorem. The calculation shows that difluoraimine has three overlapping bands between 15 and 16 eV. The calculated results compare well with the experimental values. The photoelectron spectrum of difluoramine is compared with that of OF2 and CH2F2. 相似文献
103.
A detailed singlet potential energy surface(PES) of [Si,C,O,O] system including a van der Waals (vdW) comples SiO……CO2,eight isomers,and twelve transiton states is investigated by MP2 and QCISD(T) (single-point)methods.At the final QCISD(T)/6-311 G(2df)//MP2/6-311G(d) level with zero-point energy included,the complex SiO……CO is found to be thermodynamically and kinetically the most stable species.Although eight ismoers are located as local energy minima,they are rather unstable toward isomerization to the dissociation fragments or comples.For the reaction of silocon atoms with carbon dioxide,two competitive reaction channels are found,and the primary pathway,which leads to the products of SiO and CO fragments,is the direct oxygen-abstraction process from carbon dioxide by silicon atom with a41.16 kJ/mol reaction barrier height.Our predications are in good agreement with previous experimental and theoretical studies. 相似文献
104.
利用热力学循环方法,通过pK和有关电化学数据的测定,首次得到了NAD(P)H的辅酶模型物(BNAH)按不机理还原质子化N-芳基芴亚胺的各基元步骤的自由能变化,结合得到的同位素标纪结果,从热力学趋动力的角度区分了氢负离子的转移机理。 相似文献
105.
Hua Lin XIE Yu Jie LI Xi Du NIE Li Bo LI 《中国化学快报》2006,17(7):945-948
Because of its high sensitivity, wide dynamic range and relative freedom from interferences, inductively coupled plasma mass spectrometry (ICP-MS) has been developed for the determination of trace and ultra-trace levels of elements in various fields1. Due… 相似文献
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108.
SynthesisandMagneticPropertiesofBinuclearMn(Ⅱ)ComplexeswithAlkoxideBridgeYanShi-ping;FanBo;LiaoDai-zheng;JiangZong-huiandWang... 相似文献
109.
Michael?Sch?ferlingEmail author Michael?Riepl Petra?Pavlickova Hubert?Paul Dev?Kambhampati Bo?Liedberg 《Mikrochimica acta》2003,142(4):193-203
Two different types of -substituted alkanethiol/disulfide compounds have been used to prepare monolayer architectures on gold serving as platforms for the immobilization of receptor probe molecules – antibodies. These are: (i) carboxylic acid alkanethiols post-reacted with amino biotin to generate streptavidin surfaces, and (ii) N-hydroxysuccinimide-terminated disulfide surfaces. The properties of the monolayers, with and without attached receptor probe molecules, were analysed using infrared spectroscopy, ellipsometry, fluorescence scanning and atomic force microscopy. Several experimental parameters, such as condensation reagents, additives, probe and target concentrations and immobilization time, were systematically varied to determine the dynamic range and to optimize the sensitivity and signal-to-noise ratio of the biochip platforms. Fluorescence screening using Cy5-labelled antigens finally demonstrated that both surfaces could be successfully employed to immobilize the antibodies. The pros and cons of the two approaches are also discussed.Received November 15, 2002; accepted March 25, 2003
Published online July 28, 2003 相似文献
110.
1 INTRODUCTION Opioid analogues still remain important drugs for the relief of severe pain and morphine is still the drug of choice in such situations. For many years, the search for new centrally acting opioid deriva- tives with pain-relieving properties and without un- desired side effects, such as addiction, obstipation, etc., has been the goal of a large number of scien- tists[1-3]. Consequently, a wide variety of modifyca- tions of the well-known alkaloids morphine, codeine and thebai… 相似文献