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However, the thermal stability of metallic coordination polymer hardly enhanced in comparison with the polymer never coordinated transitional metallic ions. The reason might be that the energy of coordinate bond formed between metallic ion and polymer was trival in comparison with that of covalent bond in polymer. It started with coordinate bond when the coordinate polymer decomposed under high temperature, so it engendered little for the thermal stability at high temperature.

而金属配聚物较未配位金属的配体高温热稳定性提高不大,可能是由于金属离子与配体之间形成配位键的键能与配位体内的共价键键能相比要小得多,当金属配聚物受热裂解时,首先从配位键开始,因此对高温热稳定性的影响甚微。

In complex 1,Cucan be described as a four-coordinated square planar geometry.Compound 8 is the sodium salt of plumbagin and exists as ionic compound.Compounds 9-16 are the rare earth complexes of plumbagin with La,Y,Dy,Sm,Gd,Nd,Erand Eu.Compound 17 is binuclear Y complex.18 is mononuclear Ycomplex with plumbagin and another ligand from Plumbago Zeylanica.Compounds 19-21 are the ternary complexes with plumbagin and 2,2\'-bpy and phen as assistant ligand.In 19, the geometry of Cucan be described as five-coordinated distorted square pyramid that exists in a dimer through the weak bonding,and 1-D chain structure is formed by intermolecular hydrogen bonds.

化合物1的单晶结构分析表明1具有四配位平面四边形结构,化合物8是白花丹素的Na盐,以离子化合物形式存在;化合物9~16为白花丹素的La,Y,Dy,Sm,Gd,Nd,Er,Eu的稀土金属配合物;化合物17是白花丹素的双核钇结构;化合物18为白花丹素的单核钇结构,该配合物除了含白花丹素外,还有来自白花丹植物中的另一个单体化合物也参与配位;化合物19~21是以2,2\'-联吡啶和邻菲咯啉等含N配体为辅助配体,具有白花丹素—含N配体—金属离子的三元配合物,化合物19是白花丹素和2,2\'-联吡啶与Cu的配合物,具有五配位的四方锥构型,通过Cu…O弱的成键作用形成二聚体,再通过分子间的氢键作用进一步形成一维链状结构,化合物20和化合物21是白花丹素分别与2,2\'-联吡啶和邻菲咯啉的Zn配合物,都具有六配位八面体构型的双核锌配合物,呈一维链状结构,化合物20中链与链之间的大量氢键将一维链扩展成二维层,分子间的π-π堆积作用进一步形成三维结构。

The formation mechanism of the screw structures on the surfaces of polytype crystals is discussed according to the theoretical model of anionic coordination polyhedron growth units.

本文用负离子配位多面体生长基元理论模型讨论了多型性晶体表面螺旋结构的形成,提出在多型性晶体中配位多面体呈层状分布,配位多面体的面为层的边界,上、下层负离子配位多面体不是呈镜象对称的,在三方晶系和六方晶系的晶体中是沿晶轴a、b错开,上、下两层负离子配位多面体体呈交叉对应,从而达到稳定平衡。

The copper ions showed four different coordination numbers and geometrical structures. 4 coordination, planar quadrangle; 5 coordination, tetragonal pyramid; 6 coordination, octahedron; 7 coordination, triagonal bipyramid.

晶体结构分析表明,该配合物中存在 [Cu2]2+、[Cu2(H2O)]2+和[Cu6(H2O)65Cu24]4-三种配位离子,铜原子呈现四种不同的配位数和几何构型,它们是:4配位的平面四边形;5配位的四方锥型;6配位的八面体型;7配位的三角双锥型。

The crystal structures have been determined by single-crystal X-ray diffraction.Cadmium atoms in compounds 1 and 2 show an eight-coordinated distorted square-antiprismatic geometry and a seven-coordinated distorted pentagonal bipyramidal geometryrespectively. Copper atoms in compounds 3 and 4 show a six-coordinated distorted threeprismatic geometry and a four-coordinated distorted tetrahedral geometry respectively.

所有配合物的晶体结构都通过单晶X-射线衍射确定:配合物1中的镉离子周围显示八配位的扭曲四方反棱柱构型;而配合物2中的镉离子周围显示七配位的扭曲五角双锥构型;配合物3中的铜离子周围显示六配位的扭曲三棱柱构型;配合物4中的铜离子周围显示四配位的扭曲四面体构型;配合物5中的锌离子周围显示六配位的扭曲八面体构型。

The results showed that the mole ratio of three ligands to CoCl_2, NiCl_2 were 1:1 and to CuCl_2, ZnCl_2, CdCl_2 were 2:1, The IR, UV-Vis and FS of complexes were investigated. Their IR peaks were classified as the corresponding groups or bonds; The relation of their structure with the conjugative effects, absorbtion wavelength and molar absorb coefficients were discussed with the UV-Vis and FS.

结果表明:噻唑类配体与金属CuCl_2,CdCl_2配位比分别2∶3和3∶2,至于配位机理还需进一步探讨;硒二唑配体与CoCl_2和NiCl_2配位比均是1∶1,而与CuCl_2、ZnCl_2和CdCl_2的配位均为比2∶1;对配合物的IR吸收峰进行了归类与指认,并对配合物的紫外和荧光光谱进行讨论分析,推测硒二唑类化合物与金属发生配位的部位是v中Se原子与金属配位

The polymer features with two kinds of zinc centers: one is hexa-coordinated by four water ligands, two oxygen atoms of two formates and the other is coordinated by six oxygen atoms of six formates.

配位聚合物具有两种Zn配位中心,其中一个六配位的Zn中心跟四个水和两个甲酸根各一个氧原子配位,另一个六配位的Zn中心跟六个甲酸根各一个氧原子配位

A coordination compound 配位化合物 is one in which the metal ion or atom is bonded to one or more neutral molecules or anions so as to be a defined and integral structural unit.

配位化合物是中心原子与一定数量的分子或离子形成的具有一定的空间结构的配离子或分子,有时称络合物。

The complexing properties of compounds 10a, 10b, 11a and 11b toward alkali metal ions were studied by 〓H NMR titration, ESI-MS, UV-Vis spectra, Fluoresence spectra and liquid-liquid extraction. The results show:(1) the 1:1 complexes were formed.(2) The calix-crown 10a, 11a have a higher selectivity for Na〓 ions, whereas 10b, 11b for K〓 ions.(3) The complexing ability toward alkali metal ions was enhanced when the calix-crown have side arm carbonyl.(3) The coordination of alkali metal ions toward phenoxy, carbonyl and crown ethereal oxygens take place by rotation around the carbon-carbon bond of carbonyl and methylene.

六,用〓H NMR滴定,ESI-MS,UV-Vis,Fluorescence,液-液萃取实验研究了10a,10b,11a和11b对金属离子的配位性质,研究结果表明:1)杯芳烃冠醚衍生物同碱金属离子形成了1:1配合物,化合物10a、11a对Na〓具有较高的配位能力,化合物10b、11b对K〓具有较高的配位能力;2)在杯冠醚环的旁边引入带有羰基氧原子的基团作为侧臂参与配位可以加强对碱金属离子的配位能力;3)金属离子分别同苯酚氧,羰基氧,聚氧醚链氧发生了配位配位过程中侧链基团涉及到了羰基碳与亚甲基碳的碳碳键的旋转过程。

Complexes 7-12, 16, 22 and 23 are dimeric molybdatesor dimeric tungstates, the central metal with citrate or malate in a molar ratio of 1:1. Theanions of these complexes have two metal atoms and two ligands. Each ligand acts as atridentate fashion via theirα-alkoxy,α-carboxy andβ-carboxy groups coordinated to eachmetal atom. Complex 13 is a monomeric molybdate. The citrate ligand coordinates tomolybdenum with itsα-alkoxy,α-carboxy andβ-carboxy groups in a tridentate mode.

其配阴离子中都含有2个金属原子和2个配体,且配体均以α-烷氧基、α-羧基和β-羧基氧与中心金属三齿配位。13是单核柠檬酸钼配合物,柠檬酸也以α-烷氧基、α-羧基和β-羧基氧与钼三齿配位。17和21分别为苹果酸钼、柠檬酸钨单核配合物,其中苹果酸、柠檬酸配体均以α-烷氧基氧和α-羧基氧与金属双齿配位

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