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Three open chain crown ether s and triglycolyl isopropylidene hydrazide complexes of rare earth nitrate were synthesized for the first time with isoproylidene hydrazide as the terminal group and through IR, 1HNMR, MS, characterized their structures have been characterized.

首次合成了以丙酮酰腙为端基的3种双酰腙型开链冠醚及三甘双酰丙酮腙稀土硝酸盐配合物,并通过元素分析,IR,1HNMR,MS对分子结构进行了表征

A quantum chemistry calculation for the crystal structure of 4- benzaldehyde-2,4-dinitro phenyl hydrazone was performed by using Gaussian98 with B3LYP/6-31G basis sets.

利用Gaussian98程序,采用密度泛涵方法(B3LYP/6-31G)对4-苯甲醛缩-2,4-二硝基苯腙化合物的晶体结构进行了量化计算,利用相关参数推测了它的分子特性,结果表明,该化合物的分子结构为一大平面结构,难与金属形成配合物

The synthesis, crystal structure and characterization of 4, 5-dimethyl-2-(2-pyridyl) imidazole were reported.

为了制备研究2-取代咪唑配合物,设计合成了4, 5-二甲基-2-(2-吡啶基)咪唑,用IR、MS、1H-NMR对其结构进行了确证,并对其晶体结构进行了分析。

The synthesis and characterization of 3,3'trimethylenedi indene and divalent rareearth 3,3'-trimethylenediindenyl complexes

3,3'-三亚甲基二茚和二价稀土3,3'—三亚甲基二茚基配合物的合成与表征

These experiments suggest that the aromatic moiety on the side chain of the ligands may partially intercalate into the base pairs of DNA.

说明这三个配合物是以配体支链上的芳香环平面部分地插入到相邻碱基对之间与DNA结合的。

Researcher who held the post of the media literacy lecture for the past three years, discover through the interaction with the teacher who join the seminar or the teaching team who need the counseling, it's not easily to implement media literacy in the school, lay in the teacher to be insufficient regarding the media elementary knowledge, causes to be unable independently to design the teaching activity, however in the market although had few publications to be allowed to instruct the media literacy teaching, but in the teaching activity often needed to use the massive media model, those had to collect by the teacher voluntarily, moreover most of these curricula taken the independent teaching, didn't intergrade and coordinated with the existing curriculum, therefore could have the problem in the teaching time.

研究者以三年来担任媒体素养研习讲师,与参加研习的教师和寻求辅导的教学团队互动的经验中发现,不易在教学现场实践媒体素养教育的原因,在於教师个人对於媒体的知识基模不足,以致於无法自行设计教学活动,而坊间虽有极少数的出版品指导媒体素养教学,但教学活动中往往需要用到大量媒体范例,必须靠教师自行搜集,而且这些课程多采独立教学,并非配合现有学科进行融入教学,所以会有教学时间的困难。

An incremental-iterative method based on the Newton-Raphson method combined with constant arc length of incremental displacement vector is employed for the solution of nonlinear equilibrium equations.

本文解非线性平衡方程式式的数值计算方法是基於牛顿-拉福森(Newton-Raphson)法配合弧长控制法的增量迭代法。

The ground and excited states of mono- and di-nuclear terpyridyl Pt complexes +(1) and (2) were explored by using the first principle based on a DFT method.

采用基于第一性原理的密度泛函理论对单核和双核三联吡啶Pt配合物+(1)和PtC≡(2)的基态和激发态以及光谱性质进行了系统研究。

The tetraoxazoline ligands only afforded the-configuration whether monometallic and/or bimetallic palladium complexes were formed upon the complexing process. Using the chelation-induced axially chiral palladium complex as a catalyst, excellent catalytic activities and enantioselectivities in the Wacker- type cyclization of allylphenols with up to 99% ee were gained.

当它与钯离子配位后只得到了轴构型为S的单金属或双金属配合物,并将该配体应用于钯催化的邻烯丙基苯酚的Wacker-type环化反应中,获得了很好催化活性和高达99% ee。

Comparing with the structure of heme group that covalently linked to the polypeptide chain in natural heme proteins, we simulated the covalent modification of artificial Fe-salophen complex with amino acid histidine or dipeptide cysteinyl-histidine, with the intention of providing useful information for design of metalloproteins containing nonnatural prosthetic group.

通过比较天然血红素蛋白中血红素与多肽链进行共价连接的结构,我们对组氨酸或二肽半胱氨酰-组氨酸共价修饰人工配合物Fe-salophen进行了计算机模拟,旨在为设计包含非天然辅基的金属蛋白分子提供有用的信息。

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