二[1,2-二硫代(3,5-二硫杂-4-硫酮)戊烯]铜和锌络合物的四丁基胺盐的晶体结构

1,2-二硫代烯基(1)和1,2-二硫代苯基(Ⅱ)类型的金属络合物的研究,已有很多报道。但Ⅰ和Ⅱ与Zn的络合物的晶体结构至今未见报道。Gray等人发现在[N(C_4H_8)_4]_2[M′(MNT)_2]络合物的X射线粉末图中,Co,Pt,Ni络合物的衍射花样完全相同,但Zn络合物的确有明显的不同。Billig等人在[N(C_2H_5)_4]_2[M″(MNT)_2](M″=Cu,Ni,Zn)络合物的X射线粉末花样中也观察到同样的现象。他们认为Zn络合物为四面体的构型,但未测定其结构。近来,Lindqvist又推出一种1,2-二硫代(3,5-二硫杂-7-硫酮)戊烯基(Ⅲ)新的配位体。为了解Cu,Zn与Ⅲ形成络合物的特征,本文测定了标题络合物的晶体结构。     

新型化合物[Ni(en)3]2[Ni(en)2(H2O)2][As6V15O42]·4H2O晶体的水热合成与表征

金属氧酸盐因其在医药临床、工业催化、功能材料等方面的广泛应用而引起人们的关注[1～6], 其中, 有关钒化学的研究一直很活跃, 钒具有与钼、钨明显不同的结构特性, 钒可以采取VO4, VO5和VO6方式配位, 同时, 钒的价态可以是+3, +4和+5价. 由于钒可采取多种配位方式及多种价态, 与钼酸盐和钨酸盐相比, 钒酸盐更具有结构柔顺性, 同时易形成低价或混合价态物种.在以往的文献中, 有关P-V-O体系多金属氧酸盐的水热合成的研究已有大量的报道[7], 在常规溶液合成中, 人们已对As-V-O体系进行了相对深入的研究, 而有关水热合成的研究报道却很少, 已见报道的砷钒化合物有K6*6H2O[8,9], 4-[10], 6-[11](X=SO2-3, SO2-4, H2O). 为了探究水热条件下As-V-O体系的反应特性, 我们开展了这方面的研究工作, 并取得了突破性进展. 本文采用中温水热技术合成了含有机基团的砷矾超分子化合物2**4H2O, 探讨这类化合物的非线性光学性质、催化性质及其它功能特性将是一个非常有意义的研究领域.     

Boosting the synthesis of value-added aromatics directly from syngas via a Cr2O3 and Ga doped zeolite capsule catalyst

Even though the transformation of syngas into aromatics has been realized via a methanol-mediated tandem process, the low product yield is still the bottleneck, limiting the industrial application of this technology. Herein, a tailor-made zeolite capsule catalyst with Ga doping and SiO₂ coating was combined with the methanol synthesis catalyst Cr₂O₃ to boost the synthesis of value-added aromatics, especially para-xylene, from syngas. Multiple characterization studies, control experiments, and density functional theory (DFT) calculation results clarified that Ga doped zeolites with strong CO adsorption capability facilitated the transformation of the reaction intermediate methanol by optimizing the first C–C coupling step under a high-pressure CO atmosphere, thereby driving the reaction forward for aromatics synthesis. This work not only reveals the synergistic catalytic network in the tandem process but also sheds new light on principles for the rational design of a catalyst in terms of oriented conversion of syngas.

The single-pass conversion of syngas into para-xylene was realized using a bifunctional catalyst Cr₂O₃/Ga-ZSM-5@SiO₂. The Ga species facilitates the methanol consumption process by C–C coupling optimization, enhancing the yield of the target aromatics.     

Enhancement of photocurrent generation by honeycomb structures in organic thin films.

A light-emitting poly (distyryldimethylbenzene-co-triethylene glycol) rod-coil block copolymer was used to fabricate films with three-dimensionally ordered honeycomb structures by the breath-figure method. Photocurrent generation and photovoltaic performance are studied, and the dependence of photocurrent on applied electric field is investigated. Introducing the ordered porous structure significantly improves the photoelectric conversion behavior, because porous structures not only enhance the light-harvesting efficiency but also benefit charge separation and charge transfer. This phenomenon may have great prospects for enhancing the photovoltaic behavior of organic thin-film devices.     

测定晶体结构的系统试差法的研究(II)系统位相超解方程得改进

本文证明了|E(k)E(h-k)|的大小是由结构决定的。与原点无关, 在这种认识的基础上, 提出了用归一化结构振幅|E|估量它的三种模式。特别是通过四位相结构不变量的二级Noighborhood~[1,2]原理解决三位相不变量间的匹配问题而算出的|E(k)E(h-k)|_(QE), 这是在没有位相数据的情况下对它的理想的估量。予期它能改进系统试差法中位相超解方程的功能, 提高测得位相的准确性。     

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利用太阳能光解水制氢和降解有机污染物对解决能源和环境问题具有重要意义，而可见光响应催化剂的研制是实现太阳光高效利用的关键。本文从可见光响应光催化剂的设计思路出发，从电子能带结构、固溶体结构和微观复合结构三方面介绍了目前光催化剂的研究进展和发展方向。     

Over 18% binary organic solar cells enabled by isomerization of non-fullerene acceptors with alkylthiophene side chains

Side-chain engineering has been demonstrated as an effective method for fine-tuning the optical, electrical, and morphological properties of organic semiconductors toward efficient organic solar cells (OSCs). In this work, three isomeric non-fullerene small molecule acceptors (SMAs), named BTP-4F-T2C8, BTP-4F-T2EH and BTP-4F-T3EH, with linear and branched alkyl chains substituted on the α or β positions of thiophene as the side chains, were synthesized and systematically investigated. The results demonstrate that the size and substitution position of alkyl side chains can greatly affect the electronic properties, molecular packing as well as crystallinity of the SMAs. After blending with donor polymer D18-Cl, the prominent device performance of 18.25% was achieved by the BTP-4F-T3EH-based solar cells, which is higher than those of the BTP-4F-T2EH-based (17.41%) and BTP-4F-T2C8-based (15.92%) ones. The enhanced performance of the BTP-4F-T3EH-based devices is attributed to its stronger crystallinity, higher electron mobility, suppressed biomolecular recombination, and the appropriate intermolecular interaction with the donor polymer. This work reveals that the side chain isomerization strategy can be a practical way in tuning the molecular packing and blend morphology for improving the performance of organic solar cells.

     

氢化物发生—分光光度法测定染发剂中的微量铅

本文提出了用铁氰化钾将铅氧化至高价,再用氢化物发生-分光光度法测定铅的一种新方法。该法灵敏度高,简便快速,用于分析染发剂中的铅,取得了较好的效果。     

草酸电还原制取乙醛酸的研究

研究了由草酸电解还原制备乙醛酸时，温度、草酸纯度、电解时间、电极状态和电解产物对电流效率和产率的影响。实验发现，除温度和原料纯度是重要的影响因素外，电极表面的有机物吸附和电解产物－乙醛酸的浓度具有更大的影响。     

A new approach to the synthesis of α-chlorocycloalkanones

α-Chlorocycloalkanones(Ⅳ) were synthesized from cycloalkanones via potassiumα-oxocycloalkylsulfonates(Ⅱ).A two-step mechanism was proposed to explain the formation ofⅣfromⅡ.