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991.
四(三苯基膦)化钯催化的若干菲啶类化合物的合成 总被引:1,自引:0,他引:1
邻甲酰基芳基硼酸与取代邻溴苯胺经四(三苯基膦)化钯催化偶联缩合, 合成了9个菲啶衍生物。邻溴苯胺的取代基无论是吸电子或供电子基团, 反应均可顺利进行。 相似文献
992.
A white substance was got by directly heating TiSi powder on Ti foil, under Ar+O
2 atmosphere. ED, EDX, SEM and HRTEM studies reveal that the white substance consists of amorphous SiO
2 nanowires of smooth surface and uniform diameter (40-90 nm). X-ray-induced luminescent emission experiment shows that two
broad peaks are at 430 and 570 nm. A one-dimensional growth mechanism, on the basis of the one-dimensional thermal flow during
nanowire formation, is discussed. 相似文献
993.
994.
995.
不饱和链烃沸点的拓扑研究 总被引:4,自引:0,他引:4
基于邻接矩阵与边价 (fi)定义边价连接性指数 ( mF) ,其中的0 F ,1 F与 2 94种不饱和链烃 (包括烯烃、炔烃及烯炔烃 )的沸点 (Tb)关联 ,得到良好的数学模型 :ln( 70 0 -Tb) =6 5 2 3 3 1-0 0 0 4880 F2 -0 3 46771 F0 5(n =2 94,R =0 9979,R2 =0 995 8,F =3 490 4,S =5 12 ) ,该回归模型经Jackknife法检验具有总体稳健性 .可以预示 ,该指数将在定量构效关系研究中成为重要参数 . 相似文献
996.
Xiao Ying Xu Feng Cheng Jian Hua Shen Xiao Min Luo Li Li Chen Li Duo Yue Yi Du Fei Ye Shan Hao Jiang Da Yuan Zhu Hua Liang Jiang Kai Xian Chen 《International journal of quantum chemistry》2003,93(6):405-410
Docking simulation of 18 agonists with the ligand binding pocket (LBP) of PPARγ has been performed. The binding conformations and binding affinities of these agonists were obtained by use of the flexible docking protocol FlexX. Test compound calculations indicated that FlexX can reproduce the binding conformation of the crystal structure (root mean square deviation = 1.43 Å); moreover, the predicted binding affinities correlate well with the activities of these agonists. The interaction model and pharmacophore of PPARγ agonists were derived and the difference in biologic activities of these agonists can be well explained. The PPARγ agonists must have both polar head and the hydrophobic tail, which form hydrogen bonds and hydrophobic contacts with hydrophilic and hydrophobic regions of the LBP of PPARγ, respectively. In addition, a suitable linker is also necessary. © 2003 Wiley Periodicals, Inc. Int J Quantum Chem 93: 405–410, 2003 相似文献
997.
在 1× 1 0 - 3 Pa~ 4 GPa的压力和 5 80~ 930 K温度范围内 ,利用高压技术并结合机械球磨 ,研究了压力、温度和晶粒尺寸对α-Fe与非晶 BN的固态反应的影响 .发现高压和晶粒细化可以极大地促进α-Fe和非晶 BN的固态反应过程 ,α-Fe与非晶 BN发生固态反应的临界晶粒尺寸约 8nm.压力和温度对反应产物及其晶体结构有明显影响 .2 GPa和 80 0 K时 ,反应产物为具有正交结构的 Fe-N新相 ;在 3~ 4 GPa和 690~80 0 K时 ,可形成单一ε-Fex N合金相 ;而在 4 GPa和 930 K以上 ,反应产物由 Fe-N合金相转变为 Fe3B相 相似文献
998.
提出了一种铁矿粉热加工生产工艺中亚铁含量测定的新方法。在氮气保护下,用盐酸溶出样中的亚铁,在硫磷混酸介质中以重铬酸钾标准溶液滴定,并对溶样条件进行了研究。该方法简单、快速、准确,已成功地应用于氧化催化法生产氧化铁中亚铁的控制分析和成品鉴定。 相似文献
999.
Summary Two molecularly imprinted polymers (MIP) have been prepared using the acidic drug salicylic acid, which can form intramolecular
hydrogen bond, as the template and acrylamide or 4-vinylpyridine as the functional monomer. HPLC was used to evaluate the
binding performance of the MIP for the template and for several analogues. The results showed that the MIP (P2) prepared using acrylamide as the functional monomer had no molecular imprinting effect whereas that (P1) prepared using 4-vinylpyridine as the functional monomer had a significant molecular imprinting effect. The reason the molecular
imprinting effect was different for the two MIP was elucidated and the molecular recognition properties of P1 were studied in detail. It was confirmed that electrostatic interaction played an important role in the molecular recognition
of P1. Scatchard analysis showed that two types of binding site with distinctly different affinity were formed in P1. Their dissociation constants were estimated to be 7.6×10−5 mol L−1 and 3.2×10−3 mol L−1, respectively. Because P1 has high affinity and selectivity for salicylic acid not only in organic systems but also in water-containing systems, it
gives P1 the potential for use in the enrichment, separation, and detection of salicylic acid in biological fluids. 相似文献
1000.
Amorphous poly(ethylene terephthalate) was annealed at temperatures around the glass transition temperature and then heated up in differential scanning calorimeter at 20 °C min−1. It was found that the annealing favored the subsequent cold crystallization and this effect became stronger with increasing annealing temperature. The experimental results were explained by considering the structural change during the annealing. 相似文献