Synthesis and Crystal Structure of 1,4-Bis(2-hydroxymethylphenyl)-1,4-dioxabutane

1 INTRODUCTION Macrocyclic ligands and their metal complexes have received much attention due to their applications in ion transport, ion separation and as models in biomimic researches[1~7]. The synthetic methods of macrocyclic ligands and their metal complexes are mainly divided into three kinds[8]. The first one is synthesizing free ligand, then forming the metal complexes; the second is template synthesis; and the third is synthesizing the end-off or side-off precursor ligand, then c…     

共聚酯型热熔粘结纤维结晶结构及其熔融行为

采用DSC与WAXD相结合的方法研究了两个系列的无规嵌段共聚酯型热熔粘结纤维的结晶结构并探讨了系列样品的熔融行为.实验表明,以最低熔融温度为界,可将样品分为两组,每组只含一种可结晶单元的结晶.其结构与物理机械性质随该可结晶单元的加入量而有规律的变化.纤维的粘结性能则取决于非晶区结构,非晶区分子链柔性增加,会明显改善粘结效果.     

含氮宾或卡宾的金属羰基簇合物的结构化学研究——Ⅰ.H_2Fe_3(N-C_6H_5)(CO)_9和Fe_3(N-C_6H_5)(μ_3-CO)(CO)_9的合成和结构

含氮宾的两个三核羰基铁簇合物是由[Et_3NH][HFe_3(CO)_(11)]与C_6H_5NCO在苯中反应获得。应用四园衍射仪测定了H_2Fe_3(N-C_6H_5)(CO)_9(Ⅰ)和Fe_3(N-C_6H_5)(μ_3-CO)(CO)_9(Ⅱ)的晶体结构。晶体数据为:C_(15)H_7NO_9Fe_3(Ⅰ),空间群P2_1/a,a=18.343(2),b=9.072(1),c=11.451(1)(?),β=102.03(1)°,V=1863.7(?)~3,Z=4,D_c=2.143g/cm~3;C_(16)H_5NO_(10)Fe_3(Ⅱ),空间群P2_1/c,a=8.634(1),b=13.026(1),c=17.642(2)(?),β=97.68(1)°,V=1966.3(?)~3,Z=4,D_c=1.820g/cm结构系用直接法解出,最后R_(Ⅰ)因子为0.033,R_(Ⅱ)因子为0.027。测定结果表明,(Ⅰ)和(Ⅱ)分子均具有C_s对称性,且三个Fe原子共面,呈近似等边三角形结构。(Ⅰ)中面桥N原子以不对称方式与三个Fe原子成键;(Ⅱ)中面桥羰基以不对称方式与三个Fe原子键连。Fe-N和Fe-C键长分别在1.896-1.938(?)和2.006-2.110(?)之间。     

混合价聚十五钒酸盐[V_(15)O_(36)Cl](NH_4)_3Na_7·30H_2O的合成与晶体结构

以XRD法确定制得的标题晶体属空间群D_(3A)~3,a=13.111,c=11.130。结构由帕特逊-极小函数法结合差值法解出,经精修得一致性因子R_w=0.0344。晶胞中坐落在6m2特殊位置上的是包合1个Cl~-的聚十五钒酸根[V_(15)O_(36)Cl]~(10-),配合键价法确认这是四价钒占主导地位的一类特种混合价同多酸根。     

BH_3及其等电子分子片的杂化轨道和轨道相互作用

本文在文[1—3]和MNDO分子轨道计算的基础上,分析一些等电子分子片X(BH_(?)、BF_3、CH_3~+、CF_3~+)的前线杂化轨道,讨论它们同配体L(H~-、CO、CN~-、NC~-、NH_3)的轨道相互作用,从而研究X+L→XL反应的进程和产物XL分子稳定结构。     

化学光谱法测定5N氧化钆中14个稀土杂质元素

报道了化学光谱法测定５Ｎ高纯氧化钆中１４个稀土杂质元素，在Ｐ５０７萃淋树脂色层柱上分离氧化钆中稀土杂质元素，分别采用定量分离Ｌａ－Ｓｍ及Ｔｂ－Ｌｕ＋Ｙ和部份分离Ｅｕ的方法，并相应地采用碳粉吸附法和碳粉粉末法进行光谱测定。分离时间为３．５ｈ，测定下限为１．２μｇ／ｇ（ＲＥ）。     

一个二维梯状化合物[Ni(μ1，5-dca)2(en)]n的合成，结构和磁性(英)

A new nickel(Ⅱ)-dicyanamide compound, [Ni(dca)₂(en)]_n (1) (dca=dicyanamide anion, [N(CN)₂]^-); en=ethylene diamine), has been synthesized and its structure has been determined by single crystal X-ray diffraction analysis. The crystal is monoclinic, space group P2₁/n with unit cell dimensions: a=0.694 3(1) nm, b=1.041 5(2) nm, c=1.4132(2) nm, and β=90.381°, Z=4, V=1.011 0(3) nm³. In this compound, the adjacent nickel atoms are connected by dca all in μ_1，5-bridging mode to form ladder-like units, which are linked with double dca bridges to generate a regular infinite stair-like structure. Temperature-dependent magnetic susceptibility was also characterized for this compound. CCDC: 208276.     

一维链配位聚合物[Mn(acacen){N(CN)2}]n的合成、结构和性质的研究(英)

The manganese(Ⅲ) complex [Mn(acacen){N(CN)₂}]_n [H₂acacen=bis(acetylacetone)ethylenediimine] has been synthesized and the structure has been determined. The complex forms a one-dimensional chain structure via the bidentate bridge ligand μ_1,5-[N(CN)₂]^- linking [Mn(acacen)] moiety. The magnetic property of the compound (75～300 K) shows the existence of an antiferromagnetic exchange interaction among paramagnetic centers along the chain. CCDC: 244940.     

Preparation and Crystal Structure of a Charge-transfer Complex between an Organic Substrate and Molybdosilicic Acid [(CH_3)_2NH(CH_2)C_6H_5]_4SiMo_(12)O_(40)·2CH_3CN·H_2O

1 INTRODUCTION Photochromism of intermolecular complexes based on polyoxometalates has received increasing attention due to their potential applications in ma- terial science[1～3]. However, most studies of photo- chromism have been made in solution[4～7], and those in solid state are relatively less and only a few with photosenstivity properties have been studied crystal- lographically. The title compound has a light yellow color in the darkness and turns greenish when exposed to sunligh…     

{[Gd(DMF)_3(DMSO)(H_2O)_3](μ-CN)[Fe(CN)_5]}·2H_2O的合成,结构表征和磁性(英文)

0IntroductionThefirstmolecule鄄basedmagnetswerereportedin1986[1].Duringthelasttwodecades,moreandmoreattentionhasbeenpaidtothesynthesisofmolecule鄄basedmagnets,especiallytoPrussianBlueanalogu鄄es[2].TheoldPrussianBlueanalogueshavebeenbroughtuptodateduetoth…