Dielectric and elastic properties of fluorine-containing tricyclic isothiocyanate liquid crystal

The dielectric and elastic properties of liquid crystals (LCs) generally depend on the molecule structure, such as polar group and carbon chain length. For further investigation of the influence of molecular structure on the dielectric and elastic properties of fluorine-containing tricyclic isothiocyanate LC, the experimental temperature was controlled at 25°C by precision hot stage, and a precision LCR meter was used to measure the capacitance of six LC cells under the voltage from 0.1 to 20 V at 1 kHz. An LC cell capacitance model and a dual-cell model were adopted to obtain the dielectric anisotropy, and the capacitance–voltage curves of six LC materials were plotted. The threshold voltage of Fréedericksz transition was analysed, and a finite difference iterative method was used to attain specific values of three elastic constants. The influence of molecular structure on the dielectric and elastic constants was finally analysed. Experimental results showed that the introduction of meta-difluoro group would increase the dielectric anisotropy and reduce the threshold voltage of LC. As the length of the alkyl carbon chain increased, the dielectric anisotropy would have an odd–even alternation effect, which would lead to changes in the elastic constants of LC.     

液相色谱-串联质谱法检测雄蜂蛹粉中50种抗生素残留

建立了液相色谱-串联质谱检测雄蜂蛹粉中50种抗生素残留（大环内酯类、喹诺酮类、磺胺类、四环素类、硝基咪唑类、林可霉素和氯霉素）的方法。样品经高氯酸溶液和醋酸铅溶液提取沉淀蛋白质，清液用磷酸氢二钾溶液调节pH值至8，经固相萃取净化后进行仪器分析。采用多反应监测正离子或负离子模式检测，可以一次完成对雄蜂蛹粉中50种目标化合物的定性和定量测定。50种抗生素的加标回收率为70.2%~118.3%，相对标准偏差（RSD）为1.8%~13.6%。该方法操作简便，灵敏度高，适用于雄蜂蛹粉中多种兽药残留的分析确证。     

专业课"课程思政"策略的构建与实践——以基础化学原理课程为例

目前高等教育仅依靠思想政治理论课对大学生进行价值引领的局限性日趋凸显,亟需构建和实施全员育人的大思政教育体系——"课程思政"。尝试构建了专业课"课程思政"的策略。通过"培养学生的爱国主义精神、民族自豪感和自信心、对学生进行生态文明和生态安全教育、培养学生的专业品质、培养学生的专业能力"等途径,进行了基础化学原理"课程思政"实践,充分发挥了基础化学原理课程的"育德功能"。     

Three Mechanisms in One Material: Uranium Capture by a Polyoxometalate–Organic Framework through Combined Complexation,Chemical Reduction,and Photocatalytic Reduction

The design and synthesis of uranium sorbent materials with high uptake efficiency, capacity and selectivity, as well as excellent hydrolytic stability and radiation resistance remains a challenge. Herein, a polyoxometalate (POM)–organic framework material ( SCU‐19 ) with a rare inclined polycatenation structure was designed, synthesized through a solvothermal method, and tested for uranium separation. Under dark conditions, SCU‐19 can efficiently capture uranium through ligand complexation using its exposed oxo atoms and partial chemical reduction from U^VI to U^IV by the low‐valent Mo atoms in the POM. An additional U^VI photocatalytic reduction mechanism can occur under visible light irradiation, leading to a higher uranium removal without saturation and faster sorption kinetics. SCU‐19 is the only uranium sorbent material with three distinct sorption mechanisms, as further demonstrated by X‐ray photoelectron spectroscopy (XPS) and X‐ray absorption near edge structure (XANES) analysis.     

Thermal Activation of CH4 and H2 as Mediated by the Ruthenium Oxide Cluster Ions [RuOx]+ (x=1–3): On the Influence of Oxidation States

Thermal gas-phase reactions of the ruthenium-oxide clusters [RuO_x]⁺ (x=1–3) with methane and dihydrogen have been explored by using FT-ICR mass spectrometry complemented by high-level quantum chemical calculations. For methane activation, as compared to the previously studied [RuO]⁺/CH₄ couple, the higher oxidized Ru systems give rise to completely different product distributions. [RuO₂]⁺ brings about the generations of [Ru,O,C,H₂]⁺/H₂O, [Ru,O,C]⁺/H₂/H₂O, and [Ru,O,H₂]⁺/CH₂O, whereas [RuO₃]⁺ exhibits a higher selectivity and efficiency in producing formaldehyde and syngas (CO+H₂). Regarding the reactions with H₂, as compared to CH₄, both [RuO]⁺ and [RuO₂]⁺ react similarly inefficiently with oxygen-atom transfer being the main reaction channel; in contrast, [RuO₃]⁺ is inert toward dihydrogen. Theoretical analysis reveals that the reduction of the metal center drives the overall oxidation of methane, whereas the back-bonding orbital interactions between the cluster ions and dihydrogen control the H−H bond activation. Furthermore, the reactivity patterns of [RuO_x]⁺ (x=1–3) with CH₄ and H₂ have been compared with the previously reported results of Group 8 analogues [OsO_x]⁺/CH₄/H₂ (x=1–3) and the [FeO]⁺/H₂ system. The electronic origins for their distinctly different reaction behaviors have been addressed.     

Regulating PdC3/PtC3···thiophene interaction by small molecule doping (AgOTf,CuBr, CuI,CuBr2, PdCl2)

Structural Chemistry - The influences of small molecule doping on PdC3/PtC3···thiophene interaction have been investigated by atoms in molecules (AIM) theory, electron location...     

Enhancing effects of π-hole tetrel bonds on the σ-hole interactions in complexes involving F2TO (T = Si,Ge, Sn)

Structural Chemistry - The bimolecular and termolecular complexes involving F2TO (T = Si, Ge, Sn) and XCN/BrY (X = H, Br, CH3, and PH2; Y = F, CN, OH, and H)...     

Simultaneous determination of chlorpheniramine and pseudoephedrine in human plasma by liquid chromatography-tandem mass spectrometry

A sensitive and specific procedure for simultaneous quantitation of chlorpheniramine and pseudoephedrine in human plasma has been developed and validated. Analytes were extracted from plasma samples by liquid-liquid extraction, separated on a Diamonsil C18 column (250 x 4.6 mm i.d.) and detected by tandem mass spectrometry with an atmospheric pressure chemical ionization interface. Diphenhydramine was used as the internal standard. The method has a lower limit of quantitation of 0.2 and 2.0 ng/mL for chlorpheniramine and pseudoephedrine, respectively. The intra- and inter-day relative standard deviation, calculated from quality control (QC) samples were below 4.3% for chlorpheniramine and below 9.5% for pseudoephedrine. The inter-day relative error as determined from QC samples was within 4.7% for each analyte. The overall extraction recoveries of chlorpheniramine and pseudoephedrine were 77 and 61% on average, respectively. The method was successfully applied to pharmaockinetic study of chlorpheniramine and pseudoephedrine in volunteers receiving formulations containing 4 mg of chlorpheniramine maleate and 60 mg of pseudoephedrine hydrochloride.     

DFT study on the interaction between monomeric aluminium and chloride ion in aqueous solution

The interaction of monomeric aluminium and chloride ion in aqueous solution is investigated by density functional theory (DFT) calculations. The computational results show that it is difficult for Cl(-) to enter the inner-coordination shell of aluminium complexes by replacing the bound water molecules, independent of pH and the concentration of Cl(-). However, pH and the concentration of Cl(-) might influence the conformations, bond lengths and natural charge populations of monomeric aluminium complexes to a given extent. Based on the computed Gibbs energies, pK(a) values of various hydrolysis species in the presence and absence of Cl(-) are evaluated, respectively. It is concluded that pK(a) increases with the introduction of Cl(-).     

Ar离子束作用下C60薄膜的结构稳定性研究

利用XPS和AES研究了在Ar离子束作用下C60薄膜的分子结构的稳定性．研究发现C60分子与Ar离子束作用后，C1s结合能从284．7eV逐步下降到284．4eV，CKLL俄歇动能从270．0eV增加到271．3eV．并且C60薄膜在与氩离子束作用后，其C60分子结构特征的C1s携上峰及价带峰均消失．表明Ar离子束可以促使C60分子的C＝C双键断裂，离域π键消失，C60分子分解为单质碳．C＝C双键断裂过程与离子束的能量和辐照时间有一定的函数关系．