Effects of MN4-Type Coordination Structure in Metallophthalocyanine for Bio-Inspired Oxidative Desulfurization Performance

Oxidative desulfurization (ODS) is the promising new method for super deep desulfurization of fuel oil. The oxidative desulfurization performance of the metal-N₄-chelates metallophthalocyanines (MPcs) is related to the chemical properties of conjugate structures and the central metal ions. Herein, a biomimetic catalytic system composed of metallophthalocyanines (MPcR₄, M = Mn(II), Fe(II), Co(II), Ni(II), Cu(II), Zn(II); R = -H, -COOH, -NO₂, -NH₂) and molecular O₂ was performed to study the influence of MN₄-type coordination structure in metallophthalocyanines for the degradation of dibenzothiophene (DBT) in model oil containing n-octane. The results reveal that the conjugate structures and the center metal ions of metallophthalocyanines played key roles in oxidative desulfurization performance. The inductive effect of different R substituents strongly affected the electron cloud distribution of the conjugate structures and the catalytic performance. Moreover, the catalytic activity of MPcs, which is related to the d electronic configuration and ligand-field effects, does not sequentially increase with the increase in the d electron number of central metal ions.     

Suspension quality and power consumption of the complex multiphase flow field in a draft-tube stirred reactor

Experiment and simulation were used to study the flow fields of a liquid-solid-solid three-phase system in a draft-tube stirred reactor with a six-flat-bladed t...     

Influence of bit design on the stability of a rotary drilling system

Nonlinear Dynamics - This paper extends the RGD model originally proposed by Richard et al. (J Sound Vib 305(3):432–456, 2007, https://doi.org/10.1016/j.jsv.2007.04.015) to investigate...     

基于斜向背散射偏振拉曼光谱的{100}c-Si面内应力分析

复杂应力状态下应力分量的解耦分析对半导体的设计和制造具有重要意义。本文开展了方法学研究,首先建立了{100}晶面族单晶硅面内应力分量解耦分析模型,基于该模型,通过改变入射光和散射光的几何构型和偏振构型,可得到单晶硅拉曼频移与应力分量的解析关系。在此基础上,提出了一种利用斜向背散射偏振拉曼光谱在不同倾角、偏振方向和样品旋转角度下开展原位拉曼探测实现应力分量解耦分析的实用技术。本文通过实验验证了该方法的可靠性和适用性。     

Thermal evaluation of a heat pipe working with n-pentane-acetone and n-pentane-methanol binary mixtures

Journal of Thermal Analysis and Calorimetry - In the present study, a set of experiments were accomplished to appraise the thermal performance and heat transfer of n-pentane-acetone and...     

双β-二酮配体配位性的理论研究

基于自洽反应场(SCRF)中的极化连续介质模型(PCM), 采用密度泛函理论B3LYP/6-31G**计算了以二硫醚和芳环为桥基的两类双β-二酮配体的空间构型和电子结构, 结合其配合物晶体结构数据, 研究配体分子电子结构与配位性的关联性. 结果表明, 配体分子的几何构型、前线轨道、偶极矩和电荷布居, 与配合物构型、活性配位原子和配位形式(单核或多核、分子内或分子间)之间的关联性与一致性十分有意义. 配体的理论计算研究可以在一定层次上为配合物几何结构特征和配位特性提供合理的分析与预测.     

Separation and purification of isoflavones from Pueraria lobata by high-speed counter-current chromatography.

High-speed counter-current chromatography (HSCCC) was applied to the semipreparative separation and purification of puerarin and related isoflavones from a crude extract of Pueraria lobata. Analytical HSCCC was used for the preliminary selection of a suitable solvent system composed of ethyl acetate-n-butanol-water (2:1:3, v/v/v). Using the above solvent system the preparative HSCCC was successfully performed yielding six relatively pure isoflavones including puerarin from 80 mg of the crude extract in one-step separation.     

一种新二肟的合成及其电化学行为

修饰电极;一种新二肟的合成及其电化学行为