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本文用31P NMR方法研究了MgCl2对天然DNA溶液构象影响,首次观察到了Mg2+诱导天然DNA由B型向Z型转变。 相似文献
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应用NMR技术,其中包括:1H NMR、13C NMR、DEPT、COSY、13C-1H COSY和HMBC,对联萘酚磷酰胺的一对差向异构体的结构进行了研究.对S-R及R-R差向异构体的所有碳氢信号进行了一一归属,并依此考查了差向异构体的构象,分析结果得到了X-ray单晶衍射结果的证实. 相似文献
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基于高效镇痛剂双氢埃托啡游离碱,对蒂巴因衍生物的立体化学结构的NMR 测定方法进行了研究.结果表明,采用多频率位移选择激发一维NOESY(1D NOESY)和二维NMR(2D NMR)相结合的方法,可有效解决该类化合物1H 和13C NMR 谱复杂重叠的信号归属困难的问题.同时在阐明溶液构象的基础上,提出采用一维NOE(1D NOE)测定C-7和差向异构体的新方法.该方法简单、有效、不受样品浓度影响和杂质信号干扰,结果可靠,不需要标准品对照等优点.该结果有助于此类化合物的立体结构与生物活性关系的研究. 相似文献
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泛素是一种真核细胞信号分子,主要参与蛋白质降解和DNA修复等生命活动.泛素Ser65位被磷酸化之后,在溶液中呈现两个稳定的溶液构象,这两种构象的比例能够被pH调控,本研究利用NMR进一步发现它还受到温度影响.基于该发现,对磷酸化泛素进行了19F化学标记,利用19F NMR方法表征了不同温度下磷酸化泛素两种构象的比例,发现两者比例变化与温度之间的关系可以通过线性方程来描述,利用该方程可以通过构象比例计算样品内部温度,因此可以作为一种基于NMR检测的温度传感器.本文所开发的基于19F化学标记磷酸化泛素的温度传感器不仅能够作为体外样品温度检测的有力工具,还有望用于检测细胞内部的温度.从而有助于揭示生物学特性和功能. 相似文献
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利用1H-NMR中羰基的ASIS值在羰基周围不同的区域符号分布的经验规律,研究了一系列拟除虫菊酯化合物羰基酯键部分的构象,指出在具有α-氰基的菊酯分子中,其溶液态构象是α-氰基与酯羰基共平面的构象,而在个有α-甲基的菊酯分子中,溶液态构象是α-氢原子与酯羰基共平面的构象.本实验结果支持了Hopfinger等人用分子力学方法计算的结果,从而肯定了氰基取代的菊酯分子在溶液态下的构象与在晶体中构象的不同. 相似文献
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报道N,N'-二羧甲基大环醚双内酯(1-4)1H NMR溶剂效应,1H NMR跟踪的稳定性研究,溶剂极性影响标题化合物构象互变而表现为13C谱线特征. 相似文献
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报道了配合物[Co(tren)(DL-phenylalaninato)](ClO4)2 (Ⅰ)、Co(tren)(L-prolinato)]I2·H2O (Ⅱ)、[Co(tren) (L-valinato)]I2·1/3H2O (Ⅲ)、[Co(tren)(L-isoleucinato)]I2 (Ⅳ)、[Co(tren) ( L-leucinato)]I2 (Ⅴ) 在溶液中的NMR研究. 通过同核和异核二 维核磁共振实验归属了配合物的1H和13C NMR ,发现在配合物的空间结构 中,四齿配体(tren)的3个螯合臂中有两个构象稳定,而另一个构象不稳定,这与晶体学数据吻合. 通过变温实验和溶剂效应实验,发现在配合物Ⅲ、Ⅳ、Ⅴ中存在分子内氢键,而在晶体结构中,所有配合物都存在分子间氢键. 配合物Ⅰ、Ⅱ在溶液中的行为需进一步的研究 . 相似文献
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首次应用变温实验方法和13C核自旋弛豫方法研究了抗癌药β-榄香烯小分子的内部运动状况。结果表明β-榄香烯分子的六元环在所研究的温度范围(298~318K)内几乎是刚性的。该分子的整体滚动自扩散活化能为14kJ/mol.其六元环外侧链基团CH2=CCH3-和CH2=CH-的整体内旋转扩散活化能均为19kJ/mol.而与该六元环直接相连的甲基的内旋转扩散活化能为18kJ/mol.这个数值大大高于连在六元环上不同位置的两个侧链基团CH2=CCH3一中甲基的内旋转扩散活化能(其数值分别为了7kJ/mol和2.8KJ/mol).3个不同位置的甲基的内旋转扩散活化能有很大差别可能是由它们所处的分子空间环境不同而引起的。 相似文献
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NMR experiments on F19 nuclei in K2MnF4 single crystal are performed in the temperature region 20–300 K. In particular the angular dependence of the line shift has been found substantially due to the magnetic dipolar interaction with the Mn electron spins.
The values of the measured transferred hyperfine interaction (THI) tensor components indicate the isotropic nature of the Mn---F bond. Good agreement has been found between the lineshift values and the available susceptibility data in the temperature region 20–300 K. 相似文献
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I.H. Gul M. Anis-ur-Rehman A. Maqsood 《Physica C: Superconductivity and its Applications》2006,450(1-2):83-87
Superconducting samples with nominal composition Bi1.6Pb0.4Sr2Ca2Cu3Oδ were prepared by the conventional solid-state reaction technique. The samples have been characterized by X-ray diffraction, dc electrical resistivity, ac magnetic susceptibility and thermal conductivity. The X-ray diffraction studies were done at room temperature and the lattice constants of the material were determined by indexing all the peaks. All the above measurements show that, there exists two phases i.e. high-Tc (2 2 2 3) and low-Tc (2 2 1 2). The information obtained from dc electrical resistivity data agrees with ac magnetic susceptibility measurements. The onset temperature Tc (onset) and zero resistivity temperature Tc (R = 0) of the samples remains within the temperature 120 ± 1 K and 103 ± 1 K. Thermal conductivity has been measured with a transient plane source (TPS) technique in the temperature range 77–300 K. The estimation of the electrical resistivity change due to scattering by phonons and impurities has been discussed. An increase in thermal conductivity is observed above and below Tc (R = 0). The electron–phonon scattering time, phonon-limited mobility and the size of the electron–phonon constant are also calculated. Wiedemann–Franz law is applied to gain prediction about the magnitude of electronic and phonon contribution to the total thermal conductivity of the samples. It is observed that heat is mainly conducted by the phonons in this system. 相似文献
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J.T. Elizalde-Galindo F.J. Rivera Gmez J.A. Matutes-Aquino C.E. Botez 《Journal of magnetism and magnetic materials》2008,320(14):e58-e60
Nanostructured YCo5 (70%wt)+Y2Co17 (30%wt) composite powders were prepared by mechanical milling and subsequent annealing at 1073 K for 1.5 min. The average grain size D of the YCo5 and Y2Co17 phases, obtained from XRD data, was 14 and 12 nm, respectively. The temperature dependence of the magnetic properties was studied by DC magnetization measurements at temperatures T ranging from 3 to 300 K. Hysteresis loops (Hmax=70 kOe) show that both the coercivity HC and the squareness σr/σmax are temperature-dependent. The coercivity increases from 12 kOe at room temperature to 18 kOe at T=3 K. The observed enhanced remanence (σr/σmax>0.5) indicates that a strong exchange coupling is present at all temperatures used in this study. The maximum magnetization σmax changes little with temperature and has a value of about 70% of the effective saturation magnetization of the title compound. 相似文献
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Magnetization measurements on the Fe60Mn5Ni35 and Fe50Mn15Ni35 alloy samples were carried out in the temperature range 80T300 K and in magnetic fields up to 8 kOe. The Fe60Mn5Ni35 was found to order ferromagnetically with a Curie temperature, Tc, above 300 K. From the temperature dependence of the spontaneous magnetization, Ms, it was concluded that the magnetic behavior of Fe60Mn5Ni35 follows Wohlfarth theory of weak itinerant ferromagnet. The Fe50Mn15Ni35 sample exhibits a magnetic phase transition from ferromagnetism to paramagnetism at Tc=242 K. The critical amplitudes and critical exponents (β, γ and δ) have been determined by using Arrott plots, Kouvel–Fisher method and scaling plots of the reduced magnetization and reduced magnetic field. The values of β, γ and δ are discussed and compared with the results obtained for various theoretical models and also with the experimentally determined values for related systems obtained by others. 相似文献
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采用传统的高温固相烧结法制备了双层钙钛矿锰氧化物(La1-xGdx)4/3Sr5/3Mn2 O7 (x=0, 0.025)多晶样品. 通过X射线衍射仪研究发现样品为Sr3Ti2O7型四方结构, 空间群为I4/mmm; 磁性测量表明, Gd3+掺杂后的样品(La0.975Gd0.025)4/3Sr5/3Mn2O7的三维磁有序转变温度(TC13D)、磁化强度(M)均降低, 这是由于Gd3+的掺杂引起晶格的畸变, 从而使得晶格常数发生改变, 减弱了铁磁耦合而导致的; 通过电子自旋共振谱测量发现, 在TC3D<T<300 K温度范围内, 两样品在顺磁的基体上均有短程的铁磁团簇存在, 出现了相分离现象. 电性测量表明: 两样品分别在TC13D (La4/3Sr5/3Mn2O7 样品的三维磁有序转变温度, TC03D)<T<300 K温度范围内均以三维变程跳跃的方式导电, 分析得出Gd3+的掺杂使得载流子局域长度的减小. 这表明载流子需要吸收更多的能量才能克服晶格的束缚进行跳跃, 因此(La0.975Gd0.025)4/3Sr5/3Mn2 O7 样品的电阻较高. 相似文献
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Z.Q. Li D.X. Zhang X.H. Zhang Y.Q. Gao X.J. Liu E.Y. Jiang 《Physics letters. A》2007,370(5-6):512-516
The charge ordering characteristics in Y0.5Ca0.5MnO3 manganite, prepared by sol–gel process, have been investigated experimentally. It is found that the superlattice diffractions appear in the electron diffraction patterns recorded at low temperatures, while only basic Brag diffraction spots can be observed when temperature is higher than 300 K. This provides direct evidence for the existence of charge ordering in Y0.5Ca0.5MnO3. The magnetization and specific heat measurements indicate the charge ordering temperature of Y0.5Ca0.5MnO3 is 290 K, around which both the magnetization and specific heat reveal anomalous behaviors. We also observed that the MnO bond length changed remarkably and the effective number of carriers reduced prominently with decreasing temperature around charge ordering temperature through transform infrared spectra measurements. 相似文献
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57Fe NMR spin-echo spectra, static magnetization and X-ray diffraction measurements for Cd0.1Cu0.9Fe2O4 ferrite taken in a wide range of temperatures are presented. The X-ray studies show that above 100 K the structure is cubic. The temperature dependence of the effective magnetic field acting on 57Fe nuclei at non-equivalent tetrahedral and octahedral sites has been determined. Different thermal behaviour of the magnetic field at both sublattices and of the specific macroscopic magnetization have been found. Magnetization measurements imply that cadmium substitution does not affect the ferric ion distribution between the sublattices of the ferrite. 相似文献