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Using Pd-salen complex as an efficient catalyst for the copper-and solvent-free coupling of acyl chlorides with terminal alkynes under aerobic conditions 被引量:2
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作者 Mohammad Bakherad Amir Hossein Amin +2 位作者 Ali Keivanloo Bahram Bahramian Mersad Raessi 《Chinese Chemical Letters》 SCIE CAS CSCD 2010年第6期656-660,共5页
The palladium-salen complex palladium(Ⅱ) N,N'-bis{[5-(triphenylphosphonium)-methyl]salicylidene}-1,2-ethanediamine chloride was found to be a highly active catalyst for the copper- and solvent-free coupling react... The palladium-salen complex palladium(Ⅱ) N,N'-bis{[5-(triphenylphosphonium)-methyl]salicylidene}-1,2-ethanediamine chloride was found to be a highly active catalyst for the copper- and solvent-free coupling reaction of terminal alkynes with different acyl chlorides in the presence of triethylamine as base,giving excellent ynones under aerobic conditions. 展开更多
关键词 COPPER-FREE YNONES Pd-salen complex NEAT
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Co(II)-salen complex encapsulated into MIL-100(Cr) for electrocatalytic reduction of oxygen 被引量:1
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作者 Panpan Miao Gang Li +1 位作者 Guoquan Zhang Hong Lu 《Journal of Energy Chemistry》 SCIE EI CAS CSCD 2014年第4期507-512,共6页
Co(Ⅱ)-salen was encapsulated in MIL- 100(Cr) metal organic framework by "ship in a bottle" to synthesize a new electrocatalyst, Cosalen@MIL- 100(Cr). The material was characterized by XRD, FT-IR, UV-Vis and N... Co(Ⅱ)-salen was encapsulated in MIL- 100(Cr) metal organic framework by "ship in a bottle" to synthesize a new electrocatalyst, Cosalen@MIL- 100(Cr). The material was characterized by XRD, FT-IR, UV-Vis and N2-adsorption. The Cosalen@MIL-100(Cr) modified glassy carbon electrode exhibits a well-defined reduction peak at the potential of -0.21 V toward the oxygen reduction reaction (ORR) by cyclic voltam- metry (CV) in pH = 6.84 phosphate buffer. Almost 400 mV positive shift of potential at Cosalen@MIL-100(Cr) modified electrode for ORR compared with that at bare glassy carbon, indicates that Cosalen@MIL-100(Cr) possesses excellent electrocatalytic activity. The transferred number of electrons for ORR was determined by chronocoulometry. The result suggests that the introduction of Co(II)-salen complex into MOF increases the electrocatalytic activity via a four-electron reduction pathway. Furthermore, this electrocatalyst exhibits good stability and reproducibility. 展开更多
关键词 Co(Ⅱ)-salen complex metal-organic frameworks MIL-IOO(Cr) ENCAPSULATION ELECTROCATALYSIS oxygen reduction reaction
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Synthesis and Characterization of Chiral Organogallium and Indium Complexes with Salen Ligands 被引量:3
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作者 Fu Xing GAO Cheng Jian ZHU +2 位作者 Fang YUAN Yu Hua ZHU Yi PAN 《Chinese Chemical Letters》 SCIE CAS CSCD 2003年第2期138-140,共3页
Several new chiral organogallium and indium complexes with chiral Salen (1 and 2) as anxciliary ligands have been synthesized and characterized by elemental analysis, IR, 1H NMR and Mass spectroscopy. For the gallium... Several new chiral organogallium and indium complexes with chiral Salen (1 and 2) as anxciliary ligands have been synthesized and characterized by elemental analysis, IR, 1H NMR and Mass spectroscopy. For the gallium, mono and bimetallic complexes were obtained, whereas ring closure complexes of indium were obtained. 展开更多
关键词 Chiral complex organogallium complex organoindium complex salen ligand.
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Chiral Mn(Ⅲ) salen complex immobilized on imidazole-modified mesoporous material via co-condensation method as an effective catalyst for olefin epoxidation 被引量:1
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作者 LOU LanLan1, YU Yi1, YU Kai2, JIANG Shu1, DONG YanLing1 & LIU ShuangXi1 1 Institute of New Catalytic Materials Science, College of Chemistry, Nankai University, Tianjin 300071, China 2 College of Environmental Science and Engineering, Nankai University, Tianjin 300071, China 《Science China Chemistry》 SCIE EI CAS 2009年第9期1417-1422,共6页
An imidazole modified mesoporous material has been prepared through a co-condensation procedure and adopted to covalently anchor chiral Mn(Ⅲ) salen complex. The active centers in the as-synthesized catalyst were pres... An imidazole modified mesoporous material has been prepared through a co-condensation procedure and adopted to covalently anchor chiral Mn(Ⅲ) salen complex. The active centers in the as-synthesized catalyst were presented in the form of ionic species. The results of XRD, FTIR, DRUV-Vis, and N2 sorp-tion confirmed the successful immobilization of chiral Mn(Ⅲ) salen complex inside the channels of the modified support and the maintenance of the mesoporous structure of parent support in the immobi-lized catalyst. This heterogeneous catalyst exhibited comparable catalytic activity and enantioselectiv-ity to those of the homogeneous counterpart in the asymmetric epoxidation of unfunctionalized olefins. Furthermore, notably high turnover frequencies have been obtained over this heterogeneous catalyst for the relatively short reaction time and low catalyst amount, due in part to the ionic property as well as the uniform distribution of the active centers. 展开更多
关键词 imidazole-functionalized mesoporous material CHIRAL Mn(Ⅲ) salen complex CO-CONDENSATION asymmetric EPOXIDATION unfunctionalized OLEFINS
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Synthesis,Characterization and Crystal Structure of One Ni_2(salen)_2 Complex 被引量:2
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作者 董太玮 莫克 +3 位作者 李杲 朱成峰 席晓冰 崔勇 《Chinese Journal of Structural Chemistry》 SCIE CAS CSCD 2011年第2期247-251,共5页
A homochiral complex,Ni 2 (salen) 2 (1,salen=(R,R)-(-)-N,N-bis(3-tert-butyl-5-(4ethynylpyridyl)salicyl-idene)-1,2-diaminocyclohexane),has been synthesized and characterized by IR,microanalysis,CD spectra,T... A homochiral complex,Ni 2 (salen) 2 (1,salen=(R,R)-(-)-N,N-bis(3-tert-butyl-5-(4ethynylpyridyl)salicyl-idene)-1,2-diaminocyclohexane),has been synthesized and characterized by IR,microanalysis,CD spectra,TGA,powder and single-crystal X-ray crystallography.It crystallizes in triclinic,space group P1 with a=11.896(2),b=12.571(3),c=13.197(3),α=65.61(3),β=73.90(3),γ=75.87(3)o,V=1707.9(6) 3,Z=2,C 42 H 42 N 4 NiO 2,M r=693.51,D c=1.349 g/cm 3,F(000)=732,μ=0.612 mm-1,GOOF=1.015,the final R=0.0290 and wR=0.0796 for 9002 observed reflections with I 2σ(Ⅰ).The complex architecture is constructed by intermolecular π···π interaction and assembled into a 2D structure via C-H···π interactions between the cyclohexanes and pyridine rings. 展开更多
关键词 crystal structure salen nickel(Ⅱ) complex
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Salen金属配合物水解动力学拆分环氧氯丙烷研究进展 被引量:1
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作者 刘娜 梁光敏 +3 位作者 季久玉 周坤 罗根祥 李微 《石油化工高等学校学报》 CAS 2023年第4期53-62,共10页
环氧氯丙烷通过水解动力学拆分可得到手性环氧氯丙烷。手性环氧氯丙烷是具有很高价值的中间体,被广泛应用于医药、材料等领域。Salen是指两个相同的醛分子和一个二胺分子缩合生成的碱,其与金属化合形成的配合物被称为Salen金属配合物,... 环氧氯丙烷通过水解动力学拆分可得到手性环氧氯丙烷。手性环氧氯丙烷是具有很高价值的中间体,被广泛应用于医药、材料等领域。Salen是指两个相同的醛分子和一个二胺分子缩合生成的碱,其与金属化合形成的配合物被称为Salen金属配合物,常用于手性环氧氯丙烷的合成。综述了近年来Salen金属配合物催化剂的发展历程及其用于手性环氧氯丙烷合成的研究进展,探究了水解动力学拆分过程中催化剂的失活机理,对以Salen金属配合物为催化剂合成的手性环氧氯丙烷的应用进行了展望。 展开更多
关键词 手性环氧氯丙烷 salen金属配合物 水解动力学拆分 对映体
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Salen-Cu(II) Complex Catalyzed <i>N</i>-Arylation of Imidazoles under Mild Conditions 被引量:2
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作者 Yan Liu Qin Zhang +4 位作者 Xiaowei Ma Ping Liu Jianwei Xie Bin Dai Zhiyong Liu 《International Journal of Organic Chemistry》 2013年第3期185-189,共5页
Three inexpensive and air-/moisture-stable Salen-Cu complexes 1-3 were evaluated to be a novel class of catalysts for the N-arylation of imidazoles with aryl halides. A variety of aryl iodides, bromides underwent the ... Three inexpensive and air-/moisture-stable Salen-Cu complexes 1-3 were evaluated to be a novel class of catalysts for the N-arylation of imidazoles with aryl halides. A variety of aryl iodides, bromides underwent the coupling with imida-zoles, promoted by the complex 3, in moderate to excellent yields without the protection by an inert gas. 展开更多
关键词 salen-Cu complex N-ARYLATION Imidazole CATALYZE
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Preparation of Copolymer of Salen-crown Ether Complexes and its Catalytic Activation for Molecular Oxygen 被引量:2
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作者 Rong Min WANG Xiao Dong LI Yu Feng HE 《Chinese Chemical Letters》 SCIE CAS CSCD 2006年第2期265-268,共4页
A new stable salen Schiff base cobalt and crown ether sodium complex (SalCo-NaB18C6) was prepared through copolymerization. This copolymer complex was applied to catalytic oxidation of hydrocarbon compound with mole... A new stable salen Schiff base cobalt and crown ether sodium complex (SalCo-NaB18C6) was prepared through copolymerization. This copolymer complex was applied to catalytic oxidation of hydrocarbon compound with molecular oxygen without reductant, which was shown the higher activity and selectivity for ketone, and reused effectively. 展开更多
关键词 Copolymeric complexes CYCLOHEXENE CATALYSIS salen Schiff base crown ether.
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Enantioselective Iodolactonizations of (E)-and (Z)-5-Substituted-4-pentenoic Acid Derivatives Mediated by Chiral Salen-Co(II) Complex
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作者 NING Zhao-lun DING Jin-ying +3 位作者 JIN Ri-zhe KANG Chuan-qing CHENG Yan-qin GAO Lian-xun 《Chemical Research in Chinese Universities》 SCIE CAS CSCD 2011年第1期45-48,共4页
A number of salen-metal complexes were prepared and their enantioselective catalytic properties toward the asymmetric iodolactonization of (E)- and (Z)-5-substituted-4-pentenoic acid derivatives were investigated.... A number of salen-metal complexes were prepared and their enantioselective catalytic properties toward the asymmetric iodolactonization of (E)- and (Z)-5-substituted-4-pentenoic acid derivatives were investigated. The catalyst system based on salen-Co(II) complex exhibited moderate to good enantioselectivity with the e.e. value ranging from 53% to 74%, as well as high regioselectivity of δ- vs. γ-iodolactones. The salen-Co(II) complex showed the highest enantioselectivity on the asymmetric iodolactonizations of (Z)-5-substituted-4-pentenoic acid derivatives among these reagent-controlled iodolactonization protocols known so far. 展开更多
关键词 Asymmetric catalysis salen-complex Iodolactonization
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Chiral Salen Manganese Complex Immobilized on SBA-15:A New Heterogenized Enantioselective Catalyst forthe Epoxidation of Alkenes
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作者 XinMeiZHENG YanXingQI XiaoMingZHANG JiShuanSUO 《Chinese Chemical Letters》 SCIE CAS CSCD 2004年第6期655-658,共4页
关键词 SBA-15 chiral salen Mn(Ⅲ) complex ALKENES asymmetric epoxidation.
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Synthesis and Catalytic Performance of Environmental Friendly Co(Salen) Complex
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作者 Fan Huiyang Gan Ning +2 位作者 Tao Qiong Bao Xuhui Liu Yanping 《Meteorological and Environmental Research》 CAS 2016年第4期64-66,共3页
Schiff base was synthesized by using salicylaldehyde and ethylenediamine as raw materials,and then Co(Salen)complex was synthesized by using Schiff base and Co.The structure and purity of the samples were tested by ma... Schiff base was synthesized by using salicylaldehyde and ethylenediamine as raw materials,and then Co(Salen)complex was synthesized by using Schiff base and Co.The structure and purity of the samples were tested by mass spectrum.Then the orthogonal test method was used to study the catalytic performance of the complex in the reaction of benzil produced from benzoin,and the optimal reaction conditions were obtained finally.The results showed when the reaction temperature was 80℃,and the reaction time was 2h,the yield of benzil produced from benzoin by using Co(Salen)as catalyst reached the maximum 37.28%. 展开更多
关键词 SCHIFF base Co(salen) complex Oxidation of BENZOIN BENZYL China
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Substituent Effect of Chiraldiphenyl Salen Metal (M = Fe(Ⅱ), Co(Ⅱ), Ni(Ⅱ), Cu(Ⅱ), Zn(Ⅱ)) Complexes for New Conceptual DSSC Dyes
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作者 Shun Yamane Yuuki Hiyoshi +8 位作者 Shinnosuke Tanaka Shun Ikenomoto Takashi Numata Kazuya Takakura Tomoyuki Haraguchi Mauricio A. Palafox Michikazu Hara Mutsumi Sugiyama Takashiro Akitsu 《Journal of Chemistry and Chemical Engineering》 2017年第4期135-151,共17页
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仿生催化剂——Salen金属络合物催化不对称环氧化烯烃的基础 被引量:27
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作者 周智明 李连友 +1 位作者 徐巧 余从煊 《有机化学》 SCIE CAS CSCD 北大核心 2005年第4期347-354,共8页
Salen与卟啉、Salen金属络合物与卟啉铁的结构和性质相似,因此可将Salen金属(Salen-M)络合物认为是仿生催化剂,它们的仿生性突出表现在不对称催化反应中的高对映异构选择性.重点介绍了Salen-M络合物催化环氧化烯烃的反应机理,环氧化合... Salen与卟啉、Salen金属络合物与卟啉铁的结构和性质相似,因此可将Salen金属(Salen-M)络合物认为是仿生催化剂,它们的仿生性突出表现在不对称催化反应中的高对映异构选择性.重点介绍了Salen-M络合物催化环氧化烯烃的反应机理,环氧化合物的对映选择性与Salen配位体中的取代基效应(以取代常数σp表示)之间呈线性关系.另外,对映异构选择性的高低还与催化剂配体和底物的结构以及反应条件有关. 展开更多
关键词 salen 金属络合物 不对称环氧化 仿生 烯烃 不对称催化反应 基础 对映异构 催化环氧化 取代基效应 对映选择性 环氧化合物 催化剂配体 反应机理 线性关系 反应条件 卟啉铁 配位体 结构 相似 常数
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手性双核Salen配合物的合成与谱学性质 被引量:11
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作者 袁瑞娟 阮文娟 +2 位作者 朱必学 南晶 朱志昂 《无机化学学报》 SCIE CAS CSCD 北大核心 2004年第4期444-450,共7页
Six novel chiral dinuclear Salen complexes[Cu 2 L 1 ·H 2 O(3a),Cu 2 L 2 (3b),Ni 2 L 1 ·2H 2 O(4a),Ni 2 L 2 (4b),Mn 2 Cl 2 L 1 ·H 2 O(5a),Mn 2 Cl 2 L 2 (5b)]have been synthesized(L 1 and L 2 are chiral d... Six novel chiral dinuclear Salen complexes[Cu 2 L 1 ·H 2 O(3a),Cu 2 L 2 (3b),Ni 2 L 1 ·2H 2 O(4a),Ni 2 L 2 (4b),Mn 2 Cl 2 L 1 ·H 2 O(5a),Mn 2 Cl 2 L 2 (5b)]have been synthesized(L 1 and L 2 are chiral dimeric Salen ligands with different chain length which were synthesized from(R,R) - diaminocyclohexane,salicylaldehyde,4,4 ’- (1,10 - decaneoxy)sali - cylaldehyde,4,4 ’- (1,6 - hexyloxy)salicylaldehyde).These compounds were charactered by elemental analysis,1 H NMR,FT - IR,UV - Vis and CD spectra.The FT - IR,UV - Vis and CD spectra were discussed and compared with those of monomeric ligand and complex in detail.It was found that the spectra properties of compounds of differ - ent chain length were almost alike,and the properties of dimeric and monomeric compound were similar too.Furthermore Cotton effect and Cotton split of CD spectra of these chiral compounds were explained by the exciton interaction theory.It seemed that the direction of Cotton split depend on the configuration of diaminohexane.(R,R) - diaminohexane determine the chirality of Salen compounds as negative,and the positive and negative compo - nent of Cotton split lie at higher and lower energy respectively. 展开更多
关键词 手性双核salen配合物 合成 谱学性质 分子识别 不对称催化剂
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Mn(salen)/Al-MCM-41催化剂的制备及其对苯乙烯环氧化反应的催化性能 被引量:19
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作者 张岩 银董红 +2 位作者 伏再辉 李昌志 尹笃林 《催化学报》 SCIE CAS CSCD 北大核心 2003年第12期942-946,共5页
报道了一种用微波固相法制备Mn(salen) /Al MCM 4 1催化剂的新方法 ,并与常规制备方法进行了比较 .FT IR表征结果表明 ,微波固相方法和常规方法均能成功地将Mn(salen)配合物固载于Al MCM 4 1介孔分子筛上 ,且微波固相法制备的Mn(salen) ... 报道了一种用微波固相法制备Mn(salen) /Al MCM 4 1催化剂的新方法 ,并与常规制备方法进行了比较 .FT IR表征结果表明 ,微波固相方法和常规方法均能成功地将Mn(salen)配合物固载于Al MCM 4 1介孔分子筛上 ,且微波固相法制备的Mn(salen) /Al MCM 4 1催化剂在 1 4 4 8cm-1 处具有更强的吸收带 .比较了不同方法制备的催化剂在苯乙烯环氧化反应中的催化性能 ,发现微波固相法制备的Mn(salen) /Al MCM 4 1催化剂具有较高的催化活性和环氧化物选择性 .此外 ,催化剂的性能与制备过程中微波辐射的时间有关 .考察了反应时间和反应温度对微波固相法制备的催化剂性能的影响规律 ,随着反应时间的延长和反应温度的升高 。 展开更多
关键词 Mn(salen)配合物 AI-MCM-41分子筛 微波辐射 苯乙烯 环氧化反应
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双水杨醛缩乙二胺合铜[Cu(Salen)]/O_2催化氧化安息香 被引量:15
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作者 袁淑军 方海林 吕春绪 《化学世界》 CAS CSCD 北大核心 2004年第5期233-234,250,共3页
以72.8%的产率合成了双水杨醛缩乙二胺合铜配合物[Cu(Salen)],用正交试验法考察了该配合物对安息香的空气氧化反应的催化作用。实验发现,在水杨醛乙二胺合铜配合物的催化下,安息香经空气氧化生成苯偶酰的产率可达87.9%。
关键词 双水杨醛乙二胺 配合物 安息香 苯偶酰 氧化
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Salen-Mn配合物催化空气环氧化烯烃反应 被引量:14
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作者 刘艳华 赵继全 +2 位作者 焦永杰 张松梅 郭景芳 《石油化工》 CAS CSCD 北大核心 2004年第9期816-819,共4页
研究了Salen-Mn配合物催化空气环氧化苯乙烯的反应。考察了溶剂用量、反应温度、时间、催化剂用量以及异丁醛用量对苯乙烯环氧化反应的影响。当反应温度35℃、反应时间8 h、n(异丁醛)/n(苯乙烯)2.5、催化剂的摩尔分数0.35%时,苯乙烯... 研究了Salen-Mn配合物催化空气环氧化苯乙烯的反应。考察了溶剂用量、反应温度、时间、催化剂用量以及异丁醛用量对苯乙烯环氧化反应的影响。当反应温度35℃、反应时间8 h、n(异丁醛)/n(苯乙烯)2.5、催化剂的摩尔分数0.35%时,苯乙烯的转化率达到98.3%,环氧苯乙烷的选择性高达85.9%。实验发现,4种烯烃环氧化反应速率由快到慢的顺序为苯乙烯>环已烯>1-辛烯>1-十二烯。 展开更多
关键词 空气环氧化 salen-Mn配合物 烯烃 苯乙烯 异丁醛
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离子液体中Mn(salen)催化环己烯环氧化反应 被引量:5
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作者 陶亮 银董红 +2 位作者 谭蓉 喻宁亚 尹笃林 《催化学报》 SCIE CAS CSCD 北大核心 2006年第5期440-444,共5页
研究了离子液体中Mn(salen)络合物催化环己烯的环氧化反应,考察了反应介质、Mn(salen)络合物催化剂结构和反应条件等对环氧化反应的影响.在离子液体-CH2Cl2混合溶剂中,以相对廉价的H2O2为氧化剂,得到了高的环己烯转化率和环氧环己烷选择... 研究了离子液体中Mn(salen)络合物催化环己烯的环氧化反应,考察了反应介质、Mn(salen)络合物催化剂结构和反应条件等对环氧化反应的影响.在离子液体-CH2Cl2混合溶剂中,以相对廉价的H2O2为氧化剂,得到了高的环己烯转化率和环氧环己烷选择性.当以邻苯二胺和水杨醛制备的Mn(salen)络合物为催化剂,反应温度为273K时,在[bmi m]BF4-CH2Cl2的混合溶剂中,环己烯的转化率和环氧环己烷选择性分别可达100%和94·0%.此外,反应结束后,产物可以由正己烷萃取出来,解决了传统均相催化体系中催化剂与产物不易分离的问题. 展开更多
关键词 Mn(salen)络合物 离子液体 环己烯 环氧化 过氧化氢
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手性双核Salen配合物的谱学性质 被引量:5
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作者 胡国航 阮文娟 +2 位作者 张玉玲 韩华 朱志昂 《物理化学学报》 SCIE CAS CSCD 北大核心 2003年第4期320-325,共6页
合成了四个新型的手性双核(R,R)Salen配合物犤(Cu)2L·H2O(2),(Ni)2L(3),(Zn)2L·H2O(4),(MnCl)2L·2H2O(5)犦,(其中L是由(R,R)环己二胺、3,5-叔丁基水杨醛、5,5'-亚甲基二水杨醛为原料合成的手性二聚Salen配体(1)).用... 合成了四个新型的手性双核(R,R)Salen配合物犤(Cu)2L·H2O(2),(Ni)2L(3),(Zn)2L·H2O(4),(MnCl)2L·2H2O(5)犦,(其中L是由(R,R)环己二胺、3,5-叔丁基水杨醛、5,5'-亚甲基二水杨醛为原料合成的手性二聚Salen配体(1)).用元素分析、NMR、FT-IR、UV-Vis、CD光谱对配体和配合物进行了表征.在与单核的Salen配体和配合物比较的基础上,详细讨论了红外光谱、电子吸收光谱、圆二色光谱性质.发现双核配体和配合物的电子吸收光谱吸收峰的位置和形状与单核的配体和配合物基本一致,而吸收峰的强度有近似两倍的关系.另外,用激子偶合理论解释了此类手性化合物圆二色谱的Cotton效应和Cotton分裂.Cot-ton分裂的方向依赖于环己二胺的构象.(R,R)环己二胺决定了Salen化合物的手征性为负,Cotton分裂的正负两部分分别处于高能区和低能区. 展开更多
关键词 手性双核salen配合物 谱学性质 催化性能 不对称催化剂 手性金属配合物
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双核Salen锌配合物对含氮小分子的分子识别研究 被引量:7
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作者 朱必学 阮文娟 +2 位作者 高峰 曹小辉 朱志昂 《高等学校化学学报》 SCIE EI CAS CSCD 北大核心 2005年第3期412-417,共6页
合成并表征了由一定长度烷氧链桥连的新型双核 Salen Zn配合物 [简记为 C1 0 -(Salen Zn) 2 ],用紫外 -可见光谱滴定方法测定了主体 C1 0 -(Salen Zn) 2 与单齿客体咪唑 (Im)、吡啶 (Py)、双齿客体 DABCO(1 ,4-重氮双环 [2 .2 .2 ]辛烷 ... 合成并表征了由一定长度烷氧链桥连的新型双核 Salen Zn配合物 [简记为 C1 0 -(Salen Zn) 2 ],用紫外 -可见光谱滴定方法测定了主体 C1 0 -(Salen Zn) 2 与单齿客体咪唑 (Im)、吡啶 (Py)、双齿客体 DABCO(1 ,4-重氮双环 [2 .2 .2 ]辛烷 )及吡嗪 (Pyrazine)等 4种含氮客体间的轴向配位反应的配位数及缔合常数 .结果表明 ,双核主体与咪唑、吡啶和吡嗪的配位数均为 2 ,与 DABCO的配位数为 1 ;各主客体体系的缔合常数按K0 (Im) >K0 (DABCO) >K0 (Pyrazine) >K0 (Py)顺序递减 .各主客体缔合反应的热力学参数Δr H0m,Δr S0m和Δr G0m 结果表明 ,此类识别过程均为放热和熵减少的过程 .采用 1 H NMR方法和分子动力学构象搜索方法对主体 C1 0 -(Salen Zn) 2 与双齿客体 DABCO间的分子识别行为及产物构型作了合理解释 .通过量子化学计算进一步解释了主客体识别过程中光谱性质的变化 . 展开更多
关键词 双核salen ZN配合物 客体 分子识别 构象分析
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