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TDDFT-DFT Theoretical Method and Topological Analysis to the Behavior Understanding of Two Tungsten Carbonyl Complexes 两种钨羰基配合物的TDDFT-DFT理论方法和拓扑分析
IF 0.7 4区 化学 Q3 Chemistry Pub Date : 2023-01-01 DOI: 10.52568/001193/jcsp/45.01.2023
Mohamed Abdesselem Dems
We present here a study based on Density Functional Theory (DFT) calculations, to contribute to the understanding of the complexes behavior based on tungsten carbonyls ([W(C7H7NS)(CO)5], [W ( C3H6N2S)(CO)5 ] ), which consider as targets molecules of biological interest and easily detectable probes by IR spectroscopy. The results showed good agreements between the calculated and experimental values of the geometric parameters for the two complexes. A peak in the IR spectrum at 2030 cm-1 is due to the stretching of the C-O triple bond, according to the AIM analysis (0.07 andlt;ρ andlt;0.15 ), the existence of an intermediate interaction between the tungsten and the CO ligand. Moreover, these complexes are stable, the spectra of TD–DFT analysis showed these complexes absorb in the same domain of wavelengths, through absorption features at about 110-160 nm, characterized by natural transitions of HOMO/LUMO; of type MLCT for both complexes
本文基于密度泛函理论(DFT)计算,研究了基于钨羰基([W(C7H7NS)(CO)5], [W(C3H6N2S)(CO)5])的配合物行为,这些配合物被认为是生物学感兴趣的靶分子和易于通过红外光谱检测的探针。结果表明,两种配合物的几何参数的计算值与实验值吻合较好。根据AIM分析(0.07 andlt;ρ andlt;0.15),在2030 cm-1处的红外光谱峰是由于C-O三键的拉伸,钨和CO配体之间存在中间相互作用。此外,这些配合物是稳定的,TD-DFT光谱分析表明,这些配合物在同一波长域内吸收,在110 ~ 160 nm左右具有吸收特征,以HOMO/LUMO的自然跃迁为特征;两种复合物的MLCT型
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引用次数: 0
Comparison of Biological Activities and Bioactive Components of Seed, Leaf, and Blossom Parts of Camellia sinensis (L.) Kuntze and Commercial Black Tea 山茶种子、叶和花的生物活性及活性成分比较红茶和商业红茶
IF 0.7 4区 化学 Q3 Chemistry Pub Date : 2023-01-01 DOI: 10.52568/0012172/jcsp/45.02.2023
M. mer ERT RK, Elif L Elif L, Melek OL Ayvaz and Emine BA Datli Melek OL AYVAZ and Emine BA DATLI
In this study, bioactive properties and GC-MS analyses of the Camellia sinensis (seed, leaf, and blossom parts) and commercial black tea extracts were compared. The total phenolic content (TPC) and antioxidant and antimicrobial activities of extracts were determined. The gas Chromatography-Mass Spectrometry (GC-MS) technique was used to identify the major bioactive compounds in extracts. The TPC and antioxidant activity values of the alcohol extract prepared from the leaf part of the C. sinensis are higher than the other extracts. There was a strong correlation between total phenolic content and antioxidant amount among the ethanol extracts of C. sinensis. In antimicrobial evaluation, the ethanol extracts showed more activity; the ethanolic extract of C. sinensis seeds was the most effective. GC-MS results indicated various organic compounds in the C. sinensis extracts, mainly saturated and unsaturated aromatic esters, aromatic alcohols, some cyclic structures, aromatic amine, and boranic esters with different therapeutic activities. The black tea extracts exhibited a more straightforward variety of bio components as aromatic esters and boranic ester. According to the obtained results, C. sinensis and black tea extracts would exert several beneficial effects by their biological activities thanks to the possible synergistic effect of chemical contents detected by GC-MS analysis. However, GC-MS results indicated that the black tea sample had much fewer bioconstituents than fresh C. sinensis plant samples.
在本研究中,比较了茶树(种子、叶和花部分)和商品红茶提取物的生物活性特性和GC-MS分析。测定其总酚含量(TPC)和抗氧化、抗菌活性。采用气相色谱-质谱联用技术对提取物中的主要生物活性成分进行鉴定。三叶草叶乙醇提取物的TPC值和抗氧化活性均高于其他提取物。各乙醇提取物中总酚含量与抗氧化剂含量之间存在较强的相关性。在抗菌评价中,乙醇提取物表现出更强的活性;以三叶草种子乙醇提取物效果最好。气相色谱-质谱分析结果表明,紫荆提取物中含有多种有机化合物,主要是饱和和不饱和芳香酯类、芳香醇类、部分环结构、芳香胺类和硼酸酯类,具有不同的治疗活性。红茶提取物显示出更直接的生物成分,如芳香酯和硼酸酯。结果表明,GC-MS检测的化学成分可能具有协同作用,从而使三叶草与红茶提取物在生物活性上发挥多种有益作用。然而,GC-MS结果表明,红茶样品的生物成分明显少于新鲜的三叶草样品。
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引用次数: 1
The Influence of pH of Float on the Dyeability of Polyester Fabric 漂浮剂pH值对涤纶织物可染性的影响
IF 0.7 4区 化学 Q3 Chemistry Pub Date : 2023-01-01 DOI: 10.52568/001241/jcsp/45.03.2023
Milena Miljkovi Milena Miljkovi, Sandra S Konstantinovi Sandra S Konstantinovi, Vojkan M Miljkovi Vojkan M Miljkovi, Milena Nikodijevi and Du an Trajkovi Milena Nikodijevi and Du an Trajkovi
Disperse dyes are essentially non – ionic, exhibit poor solubility in water, and they can be used in the form of water dispersion. Polyester fibres are resistant to dilute aqueous acids and alkaline solutions and pH value does not provide a crucial impact on the dyeing mechanism; however, many disperse dyes undergo degradation if the pH is uncontrolled during aqueous dyeing. In order to minimize the possibility of dye hydrolysis, the dyeing is carried out in a slightly acidic medium, and pH is usually adjusted with acetic acid. In this work, the quantity of disperse dyes (Sinten Gelb P-5GL and Sinten Scharlach P-3GL) applied to polyester knitwear was investigated as a function of pH. The sorption capacity of polyester knitwear was monitored by using reflection curves and CIELab system, according to Swiss software Sandoz (based on spectrophotometry). The acetic acid was used for dyebath pH adjustment. The results showed that the maximum uptake of Sinten Gelb P-5GL and SintenScharlach P-3GL dyes by polyester knitwear occurred at pH 4.64 (0.2924%) and 6.20 (0.1860%), respectively. According to reflection curves in the range (max = 400-700 nm), the effect of pH on the sorption of Sinten Gelb P-5GL was more significant than one for Sinten Scharlach P-3GL, when concentration of dye is constant (0.4%). The CIELab values for three illuminants (daylight, light – bulb and incandescent) showed a significant dependence between pH float and hue and intensity of polyester knitwear dyeing with disperse dyes
分散染料本质上是非离子型的,在水中溶解度差,可以以水分散的形式使用。涤纶纤维耐稀酸碱性溶液,pH值对染色机理没有决定性影响;然而,如果在水染色过程中pH值不受控制,许多分散染料会发生降解。为了尽量减少染料水解的可能性,染色在微酸性介质中进行,通常用醋酸调节pH值。在这项工作中,研究了分散染料(Sinten Gelb P-5GL和Sinten Scharlach P-3GL)在涤纶针织物上的用量与ph的关系。根据瑞士软件山德士(Sandoz)(基于分光光度法),利用反射曲线和CIELab系统监测涤纶针织物的吸附能力。用乙酸调节染料槽pH值。结果表明,在pH为4.64(0.2924%)和6.20(0.1860%)时,涤纶针织品对Sinten Gelb P-5GL和Sinten scharlach P-3GL染料的吸收量最大。在400 ~ 700 nm范围内的反射曲线显示,当染料浓度恒定(0.4%)时,pH对Sinten Gelb P-5GL吸附的影响大于对Sinten Scharlach P-3GL吸附的影响。三种光源(日光、灯泡和白炽灯)的CIELab值表明,pH浮动值与分散染料对涤纶针织品染色的色相和强度有显著的相关性
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引用次数: 0
Synthesis, Structural Elucidation, and Therapeutic Screening of Organotin(IV) derivatives of oxo-ethyl carbonodithioate 羰基二硫酸氧乙基有机锡衍生物的合成、结构解析和治疗筛选
IF 0.7 4区 化学 Q3 Chemistry Pub Date : 2023-01-01 DOI: 10.52568/001282/jcsp/45.04.2023
Fatima Javed Fatima Javed, Saqib Ali Saqib Ali, Khurram Shahzad Munawar Khurram Shahzad Munawar, Ali Haider Ali Haider, N. A. S. A. Z. R. N A Shah and Z Rashid
Exploring the therapeutic potential of organotin-based oxo-ethyl carbonodithioates, a series of organotin(IV) thiocarboamates (1-5) were synthesized with diverse alkyl and phenyl substituents. The chemical- composition, morphology, theoretical properties, and drug-DNA binding capabilities of the synthesized derivatives were performed by applying different characterization techniques like FT-IR, NMR (1H, 13C), AFM, DFT analysis, and UV-Vis spectroscopy respectively. The NMR data indicated six and four coordinated geometries, while the AFM results revealed smart surfaces concerning the grain size and root mean square (RMS) roughness, signifying catalytic and biocidal uses. The drug-DNA binding via intercalative mode of interaction with blue and red shifts was determined by using using UV spectroscopy. The in vitro biocidal capacity of selected complexes was evaluated against typical bacterial, fungal, cytotoxic, and leishmanial strains respectively. As a result of the surface and biocidal characterization, the synthesized complexes may be applied with greater potential in biomedical, pharmaceutical, infectious, catalysis, and cosmetics industries
为了探索有机锡基氧乙基碳酸二硫代酸盐的治疗潜力,合成了一系列具有不同烷基和苯基取代基的有机锡(IV)硫代氨基甲酸酯(1-5)。通过FT-IR、NMR (1H, 13C)、AFM、DFT分析和UV-Vis光谱等不同的表征技术,分别对合成的衍生物的化学组成、形态、理论性质和药物- dna结合能力进行了表征。核磁共振数据显示了6和4个协调的几何形状,而原子力显微镜结果显示了与晶粒尺寸和均方根(RMS)粗糙度有关的智能表面,表明了催化和杀菌剂的用途。紫外光谱法测定了药物与dna通过蓝移和红移相互作用的插层模式结合。选择的配合物分别对典型细菌、真菌、细胞毒性和利什曼原虫进行体外杀灭能力评价。由于其表面和杀灭生物的特性,合成的配合物在生物医学、制药、感染、催化和化妆品等行业具有更大的应用潜力
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引用次数: 0
Optimization of the Production of Epichlorohydrin Catalyzed by TS-1 Using the Taguchi Method 田口法催化TS-1生产环氧氯丙烷的优化研究
IF 0.7 4区 化学 Q3 Chemistry Pub Date : 2023-01-01 DOI: 10.52568/001210/jcsp/45.02.2023
Rui Pan Rui Pan, Rumeng Jiang Rumeng Jiang, Yao Chen and Jiancheng Zhou Yao Chen and Jiancheng Zhou
Mass production of Epichlorohydrin (ECH) via epoxidizing allyl chloride suffers from determining the optimal reaction parameters and reproducibility. Titanium silicalite-1 (TS-1) catalyst has been successfully employed to reduce activation energy, but many reaction conditions are involved in the process. To optimize ECH production by analysing its yields, Taguchi method was implemented for reducing time and cost. Included in the reaction parameters were reaction temperature, reaction time and the reactant ratio. This study investigated preparation of heterogeneous catalysts using hydrothermal method and their characterization by XRD, IR, SEM and TEM, which confirmed the presence of ordered MFI structure. Plots of S/N suggested that reaction time was the most influential factor, followed by reaction time in ECH production. The optimum factor parameters were acquired as follows, a reaction time of 40 min, reaction temperature of 90 oC and the molar ratio of H2O2: allyl chloride equal to 1. Aimed at the final confirmation, ECH production experiment was also practiced. Established on the obtained results, the yield of ECH was hugely upgraded to the value of 83.13and#177;1.03 % with only ~0.7% deviated from predicted value.
环氧丙烷丙烯酰氯法大规模生产环氧氯丙烷(ECH),其最佳工艺参数和重现性的确定是一个难点。硅酸钛-1 (TS-1)催化剂已被成功地用于降低活化能,但这一过程涉及许多反应条件。通过分析其产率,采用田口法优化ECH的生产,以减少生产时间和成本。反应参数包括反应温度、反应时间和反应物比。本研究采用水热法制备了多相催化剂,并通过XRD、IR、SEM和TEM对催化剂进行了表征,证实了催化剂具有有序的MFI结构。S/N图显示,反应时间是影响乙酰胆碱合成的最大因素,其次是反应时间。结果表明:反应时间为40 min,反应温度为90℃,H2O2与烯丙基氯的摩尔比为1。为了最终确认,还进行了ECH生产试验。在此基础上,ECH的产率大幅提升至83.13和177.1.03%,与预测值仅相差约0.7%。
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引用次数: 0
Removal of Textile Dye from Aqueous Solution Using Immobilized Cells on Column pozzolana Bed Reactor 固定化细胞在柱状波佐拉床反应器上去除水溶液中的纺织染料
IF 0.7 4区 化学 Q3 Chemistry Pub Date : 2023-01-01 DOI: 10.52568/001212/jcsp/45.02.2023
Cherifi Souad Cherifi Souad, Djafer Abderrahmane Djafer Abderrahmane, Mehdaoui Razika Mehdaoui Razika, Sameut Bouhaik Izzeddine Sameut Bouhaik Izzeddine, Fizir Meriem and Iddou Abdelkader Fizir Meriem and Iddou Abdelkader
Textile dyes are hazardous and carcinogenic materials. Hence, their removal from wastewater is globally required. This research aims to remove anionic dye red bemacid E-TL from aqueous solutions using a biofilm supported on granular pozzolana in a fixed-bed column. The effect of different experimental conditions such as influent dye concentrations, flow rate and bed depth on red bemacid biosorption at room temperature were investigated. Results indicated that the breakthrough and saturation time increase with the decrease of the flow rate. The same effect is shown when the bed depth is increased. Favorable conditions for dye removal were observed with 60 cm of column height, lowest flow rate 1mL/min and initial red bemacid concentration of 60 mg/L; at which the highest removal efficiency of 52,68% were recorded. The breakthrough data obtained for RB E-TL removal fitted Thomas and Yoon-Nelson model with high correlation coefficients (R2 = 0,992). The results obtained proved that fixed microorganisms biomass could be a promising biosorbent for the removal of red bemacid from aqueous solutions in a dynamic process.
纺织染料是有害的致癌物质。因此,全球都需要从废水中去除它们。本研究的目的是在固定床柱中使用颗粒状火山灰支撑的生物膜从水溶液中去除阴离子染料红马酸E-TL。考察了染料浓度、流速、床层深度等不同实验条件对常温下红豆酸生物吸附的影响。结果表明,随着流量的减小,突破时间和饱和时间增加。当床层深度增加时,也有同样的效果。最佳脱染条件为:柱高60 cm,最低流速1mL/min,赤豆酸初始浓度60 mg/L;最高去除率为52.68%。获得的RB E-TL去除的突破性数据符合Thomas和Yoon-Nelson模型,具有高相关系数(R2 = 0,992)。结果表明,固定化微生物生物质是一种很有前途的生物吸附剂,可以在动态过程中去除水溶液中的赤豆酸。
{"title":"Removal of Textile Dye from Aqueous Solution Using Immobilized Cells on Column pozzolana Bed Reactor","authors":"Cherifi Souad Cherifi Souad, Djafer Abderrahmane Djafer Abderrahmane, Mehdaoui Razika Mehdaoui Razika, Sameut Bouhaik Izzeddine Sameut Bouhaik Izzeddine, Fizir Meriem and Iddou Abdelkader Fizir Meriem and Iddou Abdelkader","doi":"10.52568/001212/jcsp/45.02.2023","DOIUrl":"https://doi.org/10.52568/001212/jcsp/45.02.2023","url":null,"abstract":"Textile dyes are hazardous and carcinogenic materials. Hence, their removal from wastewater is globally required. This research aims to remove anionic dye red bemacid E-TL from aqueous solutions using a biofilm supported on granular pozzolana in a fixed-bed column. The effect of different experimental conditions such as influent dye concentrations, flow rate and bed depth on red bemacid biosorption at room temperature were investigated. Results indicated that the breakthrough and saturation time increase with the decrease of the flow rate. The same effect is shown when the bed depth is increased. Favorable conditions for dye removal were observed with 60 cm of column height, lowest flow rate 1mL/min and initial red bemacid concentration of 60 mg/L; at which the highest removal efficiency of 52,68% were recorded. The breakthrough data obtained for RB E-TL removal fitted Thomas and Yoon-Nelson model with high correlation coefficients (R2 = 0,992). The results obtained proved that fixed microorganisms biomass could be a promising biosorbent for the removal of red bemacid from aqueous solutions in a dynamic process.","PeriodicalId":17253,"journal":{"name":"Journal of the chemical society of pakistan","volume":null,"pages":null},"PeriodicalIF":0.7,"publicationDate":"2023-01-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"70708352","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 1
Fabrication of Porous Co3O4 Arrays by a Co-Precipitation Method and it Application as a Non-Enzymatic Glucose Sensor 共沉淀法制备多孔Co3O4阵列及其在非酶葡萄糖传感器中的应用
IF 0.7 4区 化学 Q3 Chemistry Pub Date : 2023-01-01 DOI: 10.52568/001287/jcsp/45.04.2023
Jie Zhang Jie Zhang, Ri Xia Ri Xia, Xianchun Li and Jiasheng Xu Xianchun Li and Jiasheng Xu
The porous cobaltosic oxide (Co3O4) arrays has been prepared by a chemical co-precipitation route using the nickel foam as s substrate. Cyclic voltammetry (CV), and ampere current method (i-t curve) are used to explore the non-enzymatic glucose sensor in a three-electrode system. This porous Co3O4 array non-enzymatic sensor shows a sensitivity of 592.8 mA mM1 cm2 in concentration from 0.99 M to 1.073 mM. The porous Co3O4 array sensor electrode also showed low LOD value (0.005 M) and fast response time (4 s). This porous Co3O4 electrode shows a good sensor performance due to these rich redox reaction sites in the unique porous structure. This porous cobaltosic oxide arrays maybe a potential sensor material in the glucose detection application
以泡沫镍为衬底,采用化学共沉淀法制备了多孔氧化钴(Co3O4)阵列。采用循环伏安法(CV)和安培电流法(i-t曲线)对三电极系统中的非酶葡萄糖传感器进行了研究。该多孔Co3O4阵列非酶传感器在浓度范围为0.99M ~ 1.073 mM范围内的灵敏度为592.8 mA mM (1 cm) mg (1 cm) mg(2),且具有较低的LOD值(0.005M)和快速的响应时间(4 s)。该多孔Co3O4电极独特的多孔结构中含有丰富的氧化还原反应位点,具有良好的传感器性能。这种多孔氧化钴阵列可能是葡萄糖检测中潜在的传感器材料
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引用次数: 0
Identification and Pharmacological Evaluation of Syzygium cumini Derived Fixed Oils 茴香固定油的鉴定与药理评价
IF 0.7 4区 化学 Q3 Chemistry Pub Date : 2023-01-01 DOI: 10.52568/001196/jcsp/45.01.2023
A. R. A Rauf, T. A. T Ahmad, H. A. H Ahmad, I. A. K. I A Khan, S. U. A. S. S U A Shah, A. A Ali, N. M. N Muhammad, Y. S. A. A. O. B. Y S Al Awthan O Bahattab, M. A. A. D. M A Al Duais, M. S. M. M S Mubarak
Syzygium cumini L is an evergreen medicinal plant belonging to the family Myrtaceae, and is one of the important species of the genus Syzygium. S. cumini is traditionally used to treat various infections such as sore throat, bronchitis, dysentery, and other painful conditions. The aim of the current study was to evaluate fixed oil extracted from S. cumini for various in vitro and in vivo biological activities and identification of its fatty acids constituents. GC-MS analysis of the fixed oil revealed that the major constituents are palmitic acid methyl ester (56.45%) and stearic acid methyl ester (29.54%). Fixed oil isolated from S. cumini exhibited significant effect against Staphylococcus aureus, Shigella flexenari, and Bacillus subtilis with zone of inhibition of 28.09, 27.34, and 22.76 mm, respectively. In addition, the oil exhibited antifungal effect against Aspergillus flavus, Candida glabrata, Microsporum canis, and Fusarium solani with zone of inhibition of 80.77, 75.08, 70.98, and 65.56 mm, respectively. The oil also exerted analgesic potential at the dose of 10, 20, 40, and 60 mg/Kg with 35.44, 50.45, 65.98, and 80.34 % activity in acetic acid-induced writhing model. A mild muscle relaxant effect was noted in animal models. Taken all together, the fixed oil from S. cumini exhibits significant antimicrobial, antifungal and analgesic effects, which justifies the use of this plant in folk medicine.
金合欢是桃金娘科常绿药用植物,是金合欢属重要种之一。传统上,猪链球菌用于治疗各种感染,如喉咙痛、支气管炎、痢疾和其他疼痛状况。本研究的目的是评价鱼尾草固定油的各种体外和体内生物活性,并鉴定其脂肪酸成分。GC-MS分析表明,该固定油的主要成分为棕榈酸甲酯(56.45%)和硬脂酸甲酯(29.54%)。对金黄色葡萄球菌、flexenari志贺氏菌和枯草芽孢杆菌的抑制区分别为28.09、27.34和22.76 mm。对黄曲霉、光念珠菌、canmicrosporum和solani Fusarium的抑制区分别为80.77、75.08、70.98和65.56 mm。在10、20、40和60 mg/Kg剂量下,其镇痛活性分别为35.44%、50.45%、65.98%和80.34%。在动物模型中观察到轻微的肌肉松弛作用。综上所述,该植物的固定油具有显著的抗菌、抗真菌和镇痛作用,证明了该植物在民间医学中的应用。
{"title":"Identification and Pharmacological Evaluation of Syzygium cumini Derived Fixed Oils","authors":"A. R. A Rauf, T. A. T Ahmad, H. A. H Ahmad, I. A. K. I A Khan, S. U. A. S. S U A Shah, A. A Ali, N. M. N Muhammad, Y. S. A. A. O. B. Y S Al Awthan O Bahattab, M. A. A. D. M A Al Duais, M. S. M. M S Mubarak","doi":"10.52568/001196/jcsp/45.01.2023","DOIUrl":"https://doi.org/10.52568/001196/jcsp/45.01.2023","url":null,"abstract":"Syzygium cumini L is an evergreen medicinal plant belonging to the family Myrtaceae, and is one of the important species of the genus Syzygium. S. cumini is traditionally used to treat various infections such as sore throat, bronchitis, dysentery, and other painful conditions. The aim of the current study was to evaluate fixed oil extracted from S. cumini for various in vitro and in vivo biological activities and identification of its fatty acids constituents. GC-MS analysis of the fixed oil revealed that the major constituents are palmitic acid methyl ester (56.45%) and stearic acid methyl ester (29.54%). Fixed oil isolated from S. cumini exhibited significant effect against Staphylococcus aureus, Shigella flexenari, and Bacillus subtilis with zone of inhibition of 28.09, 27.34, and 22.76 mm, respectively. In addition, the oil exhibited antifungal effect against Aspergillus flavus, Candida glabrata, Microsporum canis, and Fusarium solani with zone of inhibition of 80.77, 75.08, 70.98, and 65.56 mm, respectively. The oil also exerted analgesic potential at the dose of 10, 20, 40, and 60 mg/Kg with 35.44, 50.45, 65.98, and 80.34 % activity in acetic acid-induced writhing model. A mild muscle relaxant effect was noted in animal models. Taken all together, the fixed oil from S. cumini exhibits significant antimicrobial, antifungal and analgesic effects, which justifies the use of this plant in folk medicine.","PeriodicalId":17253,"journal":{"name":"Journal of the chemical society of pakistan","volume":null,"pages":null},"PeriodicalIF":0.7,"publicationDate":"2023-01-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"70707672","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Electrocatalytic Oxidation Performance of PbO2 Composite Electrode Doped with MXenes 掺杂MXenes的PbO2复合电极的电催化氧化性能
IF 0.7 4区 化学 Q3 Chemistry Pub Date : 2023-01-01 DOI: 10.52568/001247/jcsp/45.03.2023
Xinyu Zhang Xinyu Zhang, Jiajun Li Jiajun Li, Ming Guo Ming Guo, Kaijie Ni Kaijie Ni, Ronghui Wu and Zhiyan Hu Ronghui Wu and Zhiyan Hu
In this study, a two-dimensional transition metal carbon/nitride (MXenes) method was used to enhance the electrocatalytic oxidation behavior of PbO2 electrode. A novel composite electrode was prepared by doping the modified MXenes into PbO2 material. The electrochemical performance was tested by electrochemical workstation. The typical cationic red X-GRL was treated by electrochemical oxidation, and the electrochemical oxidation performance of the material electrode was investigated. The results demostrated that the dyes were removed by the oxygen evolution reaction at the electrodes doped with modified MXenes by passing current. The charge transfer resistance is 12.56. The electrodes have remained stable after 20 cycles of charging and discharging. And the removal rate of cationic red X-GRL was as high as 95.19% in 120 min. A high-efficiency composite electrode was developed in this study, which increased the electrodeand#39;s performance as well as wastewater degradation efficiency, and lay the groundwork for future research into doping MXenes to improve the performance of other materials. Hence, electrode materials doped with two-dimensional structured MXenes were candidates for the removal of contaminants, especially in the field of electrochemical catalysis
在本研究中,采用二维过渡金属碳/氮化物(MXenes)方法增强PbO2电极的电催化氧化行为。将改性的MXenes掺杂到PbO2材料中制备了一种新型复合电极。采用电化学工作站对其电化学性能进行了测试。对典型的阳离子红X-GRL进行了电化学氧化处理,考察了材料电极的电化学氧化性能。结果表明,在掺杂改性MXenes的电极上,通过电流发生析氧反应去除染料。电荷转移电阻为12.56。经过20次充放电循环后,电极仍然保持稳定。在120 min内,阳离子红X-GRL的去除率高达95.19%。本研究开发了一种高效复合电极,提高了电极的性能和废水降解效率,为今后掺杂MXenes改善其他材料性能的研究奠定了基础。因此,掺杂二维结构MXenes的电极材料是去除污染物的候选材料,特别是在电化学催化领域
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引用次数: 0
Study the Effect of Zwitterionic Hydrophilic Interaction for Simultaneous Determination of Non-Steroidal Anti-Inflammatory Drugs in Dosage Forms 两性离子亲水性相互作用对同时测定非甾体类抗炎药剂型的影响研究
IF 0.7 4区 化学 Q3 Chemistry Pub Date : 2023-01-01 DOI: 10.52568/001286/jcsp/45.04.2023
Ali Amer Waheb Ali Amer Waheb, Ashraf Saad Rasheed and Mohammed J M Hassan Ashraf Saad Rasheed and Mohammed J M Hassan
Flurbiprofen and ketorolac are non-steroidal anti-inflammatory drugs (NSAIDs) that include both hydrophilic and hydrophobic functional groups in their structures. By connecting sulfobetaine molecules to polystyrene-divinylbenzene particles, two ZIC-HILIC stationary phases (ZIC-SB1 and ZIC-SB4) were developed for chromatographic separation of NSAIDs with varying chain lengths using Ultraviolet as detection. The different chain lengths of the stationary phases are utilized to investigate the retention behaviour of NSAIDs. Simultaneous quantification methods for ZIC-HILIC were developed. Flurbiprofen and ketorolac exhibited high precision with a small relative standard deviation (RSD) value of 0.48%, linear ranges of 0.015-6 and 0.06-4.5 ppm and detection limits of 0.009-0.006 and 0.01-0.008 ppm with a coefficient of determination (R2) of 0.9995-0.9997 for the ZIC-SB1 and ZIC-SB4 stationary phases, respectively. Statistical testing was used to compare the approaches to the British Pharmacopoeia protocol, and no difference in accuracy was discovered.
氟比洛芬和酮酸是非甾体抗炎药(NSAIDs),其结构中包含亲水性和疏水性官能团。通过将磺胺甜菜碱分子连接到聚苯二乙烯基苯颗粒上,建立了两种ZIC-HILIC固定相(ZIC-SB1和ZIC-SB4),分别用于不同链长的非甾体抗炎药的色谱分离。利用固定相的不同链长来研究非甾体抗炎药的保留行为。建立了ZIC-HILIC的同时定量方法。ZIC-SB1和ZIC-SB4固定相的检出限分别为0.009 ~ 0.006和0.01 ~ 0.008 ppm,决定系数(R2)为0.9995 ~ 0.9997,相对标准偏差(RSD)值为0.48%,线性范围为0.015 ~ 6和0.06 ~ 4.5 ppm。统计检验用于比较方法与英国药典协议,并没有发现差异的准确性。
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引用次数: 0
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