The complexes of Fe(II), Co(II), Ni(II), and Cu(II) Schiff base ligand derived from 2,5-dihydroxy-1,4-benzoquinone and 5-amino-2-methylphenol were synthesized. The ligand was synthesized by the reaction between the mentioned ketone and amine in 1:2 molar ratio, respectively. The four metal complexes were synthesized by refluxing the ligand with the related metal(II) chloride salts. The synthesized compounds were characterized using FTIR spectroscopy, UV-visible, 1H-NMR, conductivity, atomic absorption, magnetic susceptibility, and thermogravimetric analysis. According to the results, the chelation between metals and ligand occurs with the imine groups and the deprotonated hydroxyl groups of 2,5-dihydroxy-1,4-benzoquinone and 5-amino-2-methylphenol in the ligand. The conductivity test of the four complexes shows the non-electrolytic nature of them. The magnetic susceptibility values of Fe(II), Co(II), Ni(II), and Cu(II) complexes are 4.20, 4.11, 2.97, and 2.34 B.M, respectively. The thermogravimetric and atomic absorption analyses suggest the general chemical formula for the complexes is [M2(L)(H2O)6]. In addition, the ligand and one of its metal complexes (Co(II) complex) were examined against breast cancer cells, and they gave the IC50 of 101.24 and 129.2 µg/mL, respectively. This result suggests that Co(II) complex is a better anti-cancer agent in comparison with the ligand.
{"title":"Synthesis, Characterization and Breast Anti-cancer Activity of Iron(II), Cobalt(II), Nickel(II) and Copper(II) Complexes with a Hexadentate Schiff Base Ligand Derived from 2,5-Dihydroxy-1,4-benzoquinone with 5-Amino-2-methylphenol","authors":"Riyam Baqer Ibrahim, S. T. Saad","doi":"10.22146/ijc.85611","DOIUrl":"https://doi.org/10.22146/ijc.85611","url":null,"abstract":"The complexes of Fe(II), Co(II), Ni(II), and Cu(II) Schiff base ligand derived from 2,5-dihydroxy-1,4-benzoquinone and 5-amino-2-methylphenol were synthesized. The ligand was synthesized by the reaction between the mentioned ketone and amine in 1:2 molar ratio, respectively. The four metal complexes were synthesized by refluxing the ligand with the related metal(II) chloride salts. The synthesized compounds were characterized using FTIR spectroscopy, UV-visible, 1H-NMR, conductivity, atomic absorption, magnetic susceptibility, and thermogravimetric analysis. According to the results, the chelation between metals and ligand occurs with the imine groups and the deprotonated hydroxyl groups of 2,5-dihydroxy-1,4-benzoquinone and 5-amino-2-methylphenol in the ligand. The conductivity test of the four complexes shows the non-electrolytic nature of them. The magnetic susceptibility values of Fe(II), Co(II), Ni(II), and Cu(II) complexes are 4.20, 4.11, 2.97, and 2.34 B.M, respectively. The thermogravimetric and atomic absorption analyses suggest the general chemical formula for the complexes is [M2(L)(H2O)6]. In addition, the ligand and one of its metal complexes (Co(II) complex) were examined against breast cancer cells, and they gave the IC50 of 101.24 and 129.2 µg/mL, respectively. This result suggests that Co(II) complex is a better anti-cancer agent in comparison with the ligand.","PeriodicalId":13515,"journal":{"name":"Indonesian Journal of Chemistry","volume":null,"pages":null},"PeriodicalIF":0.9,"publicationDate":"2023-12-06","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"138984309","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Gusliani Eka Putri, S. Arief, A. H. Ritonga, Wiya Elsa Fitri, Eliza Arman, Arniat Christian Telaumbanu, Rahmi Novita Yusuf
The approach to the synthesis of cerium oxide nanoparticles (CeO2NPs) using plants as capping agents has been widely researched because of its eco-friendly, low-cost, simple, effective, and reusability. In this research, we used Moringa oleifera leaf extract-mediated CeO2NPs. CeO2NPs were characterized by XRD, FTIR, SEM, TEM, and DRS UV-vis. The photocatalytic activity of CeO2NPs was tested using a phenol dye concentration of 7 mg/L with variations in photocatalyst weight of 10, 20, 30, 40, 50, 60, 70, 80, 90, and 100 mg under UV irradiation, respectively, with time variations of 15, 30, 45, 60, 75, 90, 105, 120, 135, and 150 min. SEM and TEM morphology results showed that the CeO2NPs were spherical and agglomerated. The crystal structure is cubic, with a crystal size of 18 nm with a band gap of 2.87 eV. CeO2NPs showed high photo-degradation phenol dye of 94.45% under visible light in 120 min irradiation time. The results show that M. oleifera leaf extract could be as inexpensive and safe for synthesizing other metal oxide nanoparticles, potentially having applications in the biomedical and environmental fields.
{"title":"The Green Approach of Cerium Oxide Nanoparticle and Its Application for Photo-degradation of Phenol Dye","authors":"Gusliani Eka Putri, S. Arief, A. H. Ritonga, Wiya Elsa Fitri, Eliza Arman, Arniat Christian Telaumbanu, Rahmi Novita Yusuf","doi":"10.22146/ijc.81657","DOIUrl":"https://doi.org/10.22146/ijc.81657","url":null,"abstract":"The approach to the synthesis of cerium oxide nanoparticles (CeO2NPs) using plants as capping agents has been widely researched because of its eco-friendly, low-cost, simple, effective, and reusability. In this research, we used Moringa oleifera leaf extract-mediated CeO2NPs. CeO2NPs were characterized by XRD, FTIR, SEM, TEM, and DRS UV-vis. The photocatalytic activity of CeO2NPs was tested using a phenol dye concentration of 7 mg/L with variations in photocatalyst weight of 10, 20, 30, 40, 50, 60, 70, 80, 90, and 100 mg under UV irradiation, respectively, with time variations of 15, 30, 45, 60, 75, 90, 105, 120, 135, and 150 min. SEM and TEM morphology results showed that the CeO2NPs were spherical and agglomerated. The crystal structure is cubic, with a crystal size of 18 nm with a band gap of 2.87 eV. CeO2NPs showed high photo-degradation phenol dye of 94.45% under visible light in 120 min irradiation time. The results show that M. oleifera leaf extract could be as inexpensive and safe for synthesizing other metal oxide nanoparticles, potentially having applications in the biomedical and environmental fields.","PeriodicalId":13515,"journal":{"name":"Indonesian Journal of Chemistry","volume":null,"pages":null},"PeriodicalIF":0.9,"publicationDate":"2023-12-06","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"138984450","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Due to the scarcity, studying precious metals extraction such as gold, platinum, and palladium is very critical. Solvent extraction is one of the established methods due to its simplicity and quickness but the low operational cost. In this study, a deep eutectic solvent (DES) consisting of decanoic acid and lidocaine in the molar ratio of 2:1 was applied as an extractant to extract Au(III), Pt(IV), and Pd(II) from aqueous media. Au(III) was solvated and extracted with DES in the form of AuCl3. Pd(II) was extracted by the cation exchange reaction between Pd2+ and H+. Complete extraction of Au(III) 98.2% and Pd(II) 100% can be achieved using 500 and 300 g/L DES, respectively. This finding opens new opportunities for improving Au(III) and Pd(II) extraction using an environmental friendly and inexpensive extractant.
{"title":"Extraction of Au(III), Pt(IV), and Pd(II) from Aqueous Media with Deep Eutectic Solvent Dissolved in n-Heptane as Extractant","authors":"P. D. Ola, Michiaki Matsumoto","doi":"10.22146/ijc.80862","DOIUrl":"https://doi.org/10.22146/ijc.80862","url":null,"abstract":"Due to the scarcity, studying precious metals extraction such as gold, platinum, and palladium is very critical. Solvent extraction is one of the established methods due to its simplicity and quickness but the low operational cost. In this study, a deep eutectic solvent (DES) consisting of decanoic acid and lidocaine in the molar ratio of 2:1 was applied as an extractant to extract Au(III), Pt(IV), and Pd(II) from aqueous media. Au(III) was solvated and extracted with DES in the form of AuCl3. Pd(II) was extracted by the cation exchange reaction between Pd2+ and H+. Complete extraction of Au(III) 98.2% and Pd(II) 100% can be achieved using 500 and 300 g/L DES, respectively. This finding opens new opportunities for improving Au(III) and Pd(II) extraction using an environmental friendly and inexpensive extractant.","PeriodicalId":13515,"journal":{"name":"Indonesian Journal of Chemistry","volume":null,"pages":null},"PeriodicalIF":0.9,"publicationDate":"2023-12-06","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"138984565","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
A. Purnomo, Alya Awinatul Rohmah, Weni Sri Ekowati, H. D. Rizqi, Asranudin Asranudin
The disposal of dye wastewater has become a major global concern. Meanwhile, microorganisms have shown high potential in the treatment of wastewater pollutants. In this study, the involvement of the Fenton reaction in the biodecolorization and biodegradation of methylene blue (MB) by the brown rot fungus Daedalea dickinsii was investigated. Subsequently, D. dickinsii is a fungus capable of producing hydroxyl radicals (•OH). This experiment was conducted with an initial MB concentration of 75 mg/L, and different incubation times of 0, 7, 14, 21, and 28 d respectively. The result showed that the Fenton reaction played an important role, and this was demonstrated by the addition of FeSO4 as a Fe2+ source. The removal of MB by D. dickinsii with the addition of Fe2+ reached 91.454% at 28 d in a mineral salt medium. It was higher compared to D. dickinsii culture treatment without Fe2+ addition, 86.427%. Furthermore, the metabolic degradation product was analyzed using LC-TOF/MS and identified as 2-amino-3-hydroxy-5-(methylamino) benzenesulfonic acid and N-(3,4-dihydroxy phenyl)-N-methyl formamide.
{"title":"Involvement of Fenton Reaction on Biodecolorization and Biodegradation of Methylene Blue Dye by Brown Rot Fungi Daedalea dickinsii","authors":"A. Purnomo, Alya Awinatul Rohmah, Weni Sri Ekowati, H. D. Rizqi, Asranudin Asranudin","doi":"10.22146/ijc.77689","DOIUrl":"https://doi.org/10.22146/ijc.77689","url":null,"abstract":"The disposal of dye wastewater has become a major global concern. Meanwhile, microorganisms have shown high potential in the treatment of wastewater pollutants. In this study, the involvement of the Fenton reaction in the biodecolorization and biodegradation of methylene blue (MB) by the brown rot fungus Daedalea dickinsii was investigated. Subsequently, D. dickinsii is a fungus capable of producing hydroxyl radicals (•OH). This experiment was conducted with an initial MB concentration of 75 mg/L, and different incubation times of 0, 7, 14, 21, and 28 d respectively. The result showed that the Fenton reaction played an important role, and this was demonstrated by the addition of FeSO4 as a Fe2+ source. The removal of MB by D. dickinsii with the addition of Fe2+ reached 91.454% at 28 d in a mineral salt medium. It was higher compared to D. dickinsii culture treatment without Fe2+ addition, 86.427%. Furthermore, the metabolic degradation product was analyzed using LC-TOF/MS and identified as 2-amino-3-hydroxy-5-(methylamino) benzenesulfonic acid and N-(3,4-dihydroxy phenyl)-N-methyl formamide.","PeriodicalId":13515,"journal":{"name":"Indonesian Journal of Chemistry","volume":null,"pages":null},"PeriodicalIF":0.9,"publicationDate":"2023-12-06","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"138983982","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Paracetamol contained in wastewater can cause adverse effects on animal ecosystems, such as fish living in waters and cause harmful effects on humans. Adsorption techniques are used to remove these pharmaceutical compounds. Alginate-chitosan nanoparticles are non-toxic and effectively used as adsorbents to remove pharmaceutical compounds in wastewater. Research on glutaraldehyde crosslinked alginate-chitosan nanoparticles as paracetamol adsorbent has been carried out. This research used the ionic gelation method. Nanoparticles were characterized using transmission electron microscopy (TEM), scanning electron microscope (SEM-EDX) and Fourier transform infra-red spectrophotometer (FTIR). Furthermore, the nanoparticles were used for paracetamol adsorption. The results showed that the form nanoparticles are coarse solid powder and brownish yellow. The TEM image shows an average nanoparticle size of 8.22 nm. Glutaraldehyde crosslinked alginate-chitosan nanoparticles adsorbed paracetamol with adsorption kinetics followed a pseudo-second-order or Ho-McKay model, the adsorption rate constant of 0.0324 g mg−1 min−1. The isotherm study of paracetamol adsorption by glutaraldehyde cross-linked alginate-chitosan nanoparticles followed the isotherm Dubinin-Radushkevich isotherm model with a free energy value of 707.1068 kJ mol−1, and this value indicates the adsorption process by chemically or chemisorption.
{"title":"Glutaraldehyde Crosslinked Alginate-Chitosan Nanoparticles as Paracetamol Adsorbent","authors":"Nurmala Nurmala, A. Suratman, Suherman Suherman","doi":"10.22146/ijc.82431","DOIUrl":"https://doi.org/10.22146/ijc.82431","url":null,"abstract":"Paracetamol contained in wastewater can cause adverse effects on animal ecosystems, such as fish living in waters and cause harmful effects on humans. Adsorption techniques are used to remove these pharmaceutical compounds. Alginate-chitosan nanoparticles are non-toxic and effectively used as adsorbents to remove pharmaceutical compounds in wastewater. Research on glutaraldehyde crosslinked alginate-chitosan nanoparticles as paracetamol adsorbent has been carried out. This research used the ionic gelation method. Nanoparticles were characterized using transmission electron microscopy (TEM), scanning electron microscope (SEM-EDX) and Fourier transform infra-red spectrophotometer (FTIR). Furthermore, the nanoparticles were used for paracetamol adsorption. The results showed that the form nanoparticles are coarse solid powder and brownish yellow. The TEM image shows an average nanoparticle size of 8.22 nm. Glutaraldehyde crosslinked alginate-chitosan nanoparticles adsorbed paracetamol with adsorption kinetics followed a pseudo-second-order or Ho-McKay model, the adsorption rate constant of 0.0324 g mg−1 min−1. The isotherm study of paracetamol adsorption by glutaraldehyde cross-linked alginate-chitosan nanoparticles followed the isotherm Dubinin-Radushkevich isotherm model with a free energy value of 707.1068 kJ mol−1, and this value indicates the adsorption process by chemically or chemisorption.","PeriodicalId":13515,"journal":{"name":"Indonesian Journal of Chemistry","volume":null,"pages":null},"PeriodicalIF":0.9,"publicationDate":"2023-12-06","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"138984698","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Meyliana Wulandari, Zahratussaadah Zahratussaadah, N. Nofrizal, Pandian Bothi Radja, Andreas Andreas
Indonesian black tea (BT) waste was utilized as a green corrosion inhibitor for carbon steel (CS) corrosion in a 0.5 M HCl medium. The BT extract was characterized using Fourier transform infra-red. The corrosion inhibition evaluation was studied using conventional weight loss methods, potentiodynamic polarization, and electrochemical impedance spectroscopy (EIS). Further, scanning electron microscopy-energy dispersive X-ray was applied to analyze the surface morphology of pure CS before and after contact with the inhibitor extract. After the addition of inhibitors, CS surface showed a better morphological transformation. The effect of oxygen contamination has also been studied in this research. The corrosion measurements of weight loss, potentiodynamic polarization, and EIS showed that the %IE BT extract was 84.70; 70.00; 72.80% at 0.20 g/L of inhibitor concentration. Adsorption isotherm studies have determined the reaction mechanism between the CS and inhibitor; in which the adsorption follows Langmuir. Gibbs free energy for the three methods is −16.62; −25.34; −24.35 kJ/mol, indicating electrostatic interaction (physisorption) between the metal surface and inhibitor. SEM and focus ion beam show that oxygen contamination can increase the corrosion rate resulting in CS damage. It shows that tea waste products can be used as an alternative corrosion inhibitor.
印度尼西亚红茶（BT）废料被用作 0.5 M HCl 培养基中碳钢（CS）腐蚀的绿色缓蚀剂。傅立叶变换红外光谱对红茶提取物进行了表征。采用传统的失重法、电位极化法和电化学阻抗光谱法（EIS）对缓蚀性进行了研究。此外，还利用扫描电子显微镜-能量色散 X 射线分析了纯 CS 与抑制剂提取物接触前后的表面形态。加入抑制剂后，CS 表面的形态发生了较好的变化。本研究还对氧气污染的影响进行了研究。失重、电位极化和 EIS 等腐蚀测量结果表明，在抑制剂浓度为 0.20 g/L 时，BT 提取物的 %IE 分别为 84.70%、70.00%、72.80%。吸附等温线研究确定了 CS 与抑制剂之间的反应机理，其中吸附遵循 Langmuir。三种方法的吉布斯自由能分别为 -16.62; -25.34; -24.35 kJ/mol，表明金属表面与抑制剂之间存在静电作用（物理吸附）。扫描电子显微镜和聚焦离子束显示，氧污染会增加腐蚀速度，导致 CS 损坏。这表明茶叶废品可用作替代缓蚀剂。
{"title":"Black Tea Waste as Corrosion Inhibitor for Carbon Steel in 0.5 M HCl Medium","authors":"Meyliana Wulandari, Zahratussaadah Zahratussaadah, N. Nofrizal, Pandian Bothi Radja, Andreas Andreas","doi":"10.22146/ijc.84891","DOIUrl":"https://doi.org/10.22146/ijc.84891","url":null,"abstract":"Indonesian black tea (BT) waste was utilized as a green corrosion inhibitor for carbon steel (CS) corrosion in a 0.5 M HCl medium. The BT extract was characterized using Fourier transform infra-red. The corrosion inhibition evaluation was studied using conventional weight loss methods, potentiodynamic polarization, and electrochemical impedance spectroscopy (EIS). Further, scanning electron microscopy-energy dispersive X-ray was applied to analyze the surface morphology of pure CS before and after contact with the inhibitor extract. After the addition of inhibitors, CS surface showed a better morphological transformation. The effect of oxygen contamination has also been studied in this research. The corrosion measurements of weight loss, potentiodynamic polarization, and EIS showed that the %IE BT extract was 84.70; 70.00; 72.80% at 0.20 g/L of inhibitor concentration. Adsorption isotherm studies have determined the reaction mechanism between the CS and inhibitor; in which the adsorption follows Langmuir. Gibbs free energy for the three methods is −16.62; −25.34; −24.35 kJ/mol, indicating electrostatic interaction (physisorption) between the metal surface and inhibitor. SEM and focus ion beam show that oxygen contamination can increase the corrosion rate resulting in CS damage. It shows that tea waste products can be used as an alternative corrosion inhibitor. ","PeriodicalId":13515,"journal":{"name":"Indonesian Journal of Chemistry","volume":null,"pages":null},"PeriodicalIF":0.9,"publicationDate":"2023-12-06","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"138983809","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
M. Nurhadi, R. Kusumawardani, Teguh Wirawan, Sin Yuan Lai, Hadi Nur
Fishbone-derived carbon sulfonate, modified through incipient wetness impregnation with titanium tetraisopropoxide and iron nitrate salts, displays catalytic activity in the oxidation of styrene with hydrogen peroxide (H2O2) as an oxidant. This was done to develop a cost-effective, non-toxic, and environmentally friendly bimetallic oxide catalyst, incorporating titanium and iron oxides on mesoporous-derived carbon fishbone to enhance styrene conversion and benzaldehyde selectivity in styrene oxidation using aqueous H2O2. The catalyst, featuring a combination of titanium and iron oxides on the surface of the fishbone-derived carbon sulfonate, demonstrates higher catalytic activity than single oxide catalysts, such as titanium or iron oxides alone. Factors influencing the catalyst's performance are investigated by using FTIR, XRD, XRF, SEM, and BET surface area. The results reveal that the presence of both titanium and iron oxides on the surface of the fishbone-derived carbon sulfonate and the catalyst's surface area creates a synergistic effect, the primary factors affecting its catalytic activity in styrene oxidation using H2O2 as an oxidant.
通过用四异丙醇钛和硝酸铁盐进行初湿浸渍改性的鱼骨衍生碳磺酸盐，在以过氧化氢（H2O2）为氧化剂的苯乙烯氧化过程中显示出催化活性。这项研究的目的是开发一种经济、无毒、环保的双金属氧化物催化剂，在介孔衍生碳鱼骨上结合钛和铁氧化物，以提高苯乙烯的转化率和苯甲醛在使用 H2O2 水氧化苯乙烯过程中的选择性。这种催化剂的特点是在鱼骨衍生碳磺酸盐表面结合了钛和铁氧化物，与单独的氧化物催化剂（如钛或铁氧化物）相比，具有更高的催化活性。利用傅立叶变换红外光谱、XRD、XRF、扫描电镜和 BET 表面积研究了影响催化剂性能的因素。结果表明，鱼骨衍生碳磺酸盐表面同时存在钛和铁氧化物以及催化剂的表面积产生了协同效应，这是影响其在使用 H2O2 作为氧化剂进行苯乙烯氧化时催化活性的主要因素。
{"title":"Synergistic Ti-Fe Oxides on Fishbone-Derived Carbon Sulfonate: Enhanced Styrene Oxidation Catalysis","authors":"M. Nurhadi, R. Kusumawardani, Teguh Wirawan, Sin Yuan Lai, Hadi Nur","doi":"10.22146/ijc.80667","DOIUrl":"https://doi.org/10.22146/ijc.80667","url":null,"abstract":"Fishbone-derived carbon sulfonate, modified through incipient wetness impregnation with titanium tetraisopropoxide and iron nitrate salts, displays catalytic activity in the oxidation of styrene with hydrogen peroxide (H2O2) as an oxidant. This was done to develop a cost-effective, non-toxic, and environmentally friendly bimetallic oxide catalyst, incorporating titanium and iron oxides on mesoporous-derived carbon fishbone to enhance styrene conversion and benzaldehyde selectivity in styrene oxidation using aqueous H2O2. The catalyst, featuring a combination of titanium and iron oxides on the surface of the fishbone-derived carbon sulfonate, demonstrates higher catalytic activity than single oxide catalysts, such as titanium or iron oxides alone. Factors influencing the catalyst's performance are investigated by using FTIR, XRD, XRF, SEM, and BET surface area. The results reveal that the presence of both titanium and iron oxides on the surface of the fishbone-derived carbon sulfonate and the catalyst's surface area creates a synergistic effect, the primary factors affecting its catalytic activity in styrene oxidation using H2O2 as an oxidant.","PeriodicalId":13515,"journal":{"name":"Indonesian Journal of Chemistry","volume":null,"pages":null},"PeriodicalIF":0.9,"publicationDate":"2023-12-06","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"138984585","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Nanoparticles and nanocomposites prepared by the hydrothermal method (ZnO, ZnO/MnO2) were used to build dye-sensitized solar cells (DSSCs), which were used as photoelectrodes using two natural dyes as the absorbent media: red (Hibiscus sabdariffa) and green (Apium graveolens). The results showed the efficiency of the green dye in DSSCs is superior to the red dye in terms of conversion efficiency (η). The purpose of the study is to improve the performance of dye solar cells. The properties of nanomaterials were studied by X-ray diffraction (XRD), scanning electron microscopy (FE-SEM), and transmission electron microscopy (TEM) for the analysis of ZnO NPs and ZnO/MnO2, whereas the sizes of the prepared materials are within the size of 1–100 nm. The solar cell parameters were obtained from simple (I-V) measurements for nanomaterials prepared using two-dye DSSCs where Isc represents the short circuit current through the solar cell when the voltage across the solar cell is zero, and Voc represents the open circuit voltage across the solar cell and is the maximum voltage available from the solar cell. The photoelectrochemical properties of the two dye DSSCs in this study were calculated at 22.53 mW/cm2 of the light intensity.
{"title":"Preparation and Performance of ZnO and ZnO/MnO2 Nanostructures as Anode Electrodes in DSSCs","authors":"Suaad Abd Mahdi Abd Noor, A. M. Al-Shamari","doi":"10.22146/ijc.84037","DOIUrl":"https://doi.org/10.22146/ijc.84037","url":null,"abstract":"Nanoparticles and nanocomposites prepared by the hydrothermal method (ZnO, ZnO/MnO2) were used to build dye-sensitized solar cells (DSSCs), which were used as photoelectrodes using two natural dyes as the absorbent media: red (Hibiscus sabdariffa) and green (Apium graveolens). The results showed the efficiency of the green dye in DSSCs is superior to the red dye in terms of conversion efficiency (η). The purpose of the study is to improve the performance of dye solar cells. The properties of nanomaterials were studied by X-ray diffraction (XRD), scanning electron microscopy (FE-SEM), and transmission electron microscopy (TEM) for the analysis of ZnO NPs and ZnO/MnO2, whereas the sizes of the prepared materials are within the size of 1–100 nm. The solar cell parameters were obtained from simple (I-V) measurements for nanomaterials prepared using two-dye DSSCs where Isc represents the short circuit current through the solar cell when the voltage across the solar cell is zero, and Voc represents the open circuit voltage across the solar cell and is the maximum voltage available from the solar cell. The photoelectrochemical properties of the two dye DSSCs in this study were calculated at 22.53 mW/cm2 of the light intensity.","PeriodicalId":13515,"journal":{"name":"Indonesian Journal of Chemistry","volume":null,"pages":null},"PeriodicalIF":0.9,"publicationDate":"2023-12-06","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"138984596","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Khedidja Merdja, C. Bendeddouche, Mokhtaria Drissi, Farah Chafika Kaouche, N. Medjahed, José Manuel Padrón, M. Debdab, M. Rahmouni, E. Belarbi
This work focuses on synthesizing new imidazolin-4-one derivatives (2a-c), akin to leucettamine B analogs, via microwave-assisted transamination reactions. This reaction was carried out between 3-alkyl-5-dimethylamino-2-thioxo-imidazolidin-4-one (1a-c) and aniline. The structural integrity of the synthesized compounds was confirmed using NMR and MS spectroscopy, and their configurations were validated through DFT calculations. Analyses encompassed molecular electrostatic potential, frontier molecular orbitals, HOMO-LUMO energies, energy band gap, and global chemical reactivity descriptors, providing comprehensive insights into their characteristics. The investigation extended to the biological domain, employing substance activity spectra prediction (PASS) and molecular docking with Autodock Vina4 program. Notably, this holistic assessment aimed to gauge the potential regulatory effect of the compounds on cholesterol. This integrated approach contributes to compound design understanding and potential applications, spanning drug design and broader biomedical contexts.
这项工作的重点是通过微波辅助的转氨酶反应合成新的咪唑啉-4-酮衍生物（2a-c），类似于亮胺 B 类似物。该反应在 3-烷基-5-二甲基氨基-2-硫酮-咪唑啉-4-酮（1a-c）和苯胺之间进行。合成化合物的结构完整性通过核磁共振和质谱进行了确认，其构型通过 DFT 计算进行了验证。分析涵盖了分子静电势、前沿分子轨道、HOMO-LUMO 能量、能带间隙和全局化学反应性描述符，从而全面了解了这些化合物的特性。调查扩展到了生物领域，采用了物质活性光谱预测（PASS）和 Autodock Vina4 程序进行分子对接。值得注意的是，这种整体评估旨在衡量化合物对胆固醇的潜在调节作用。这种综合方法有助于理解化合物设计和潜在应用，涵盖药物设计和更广泛的生物医学领域。
{"title":"Synthesis, Thermal, DFT Calculations, HOMO-LUMO, MEP, and Molecular Docking Analysis of New Derivatives of Imidazolin-4-Ones","authors":"Khedidja Merdja, C. Bendeddouche, Mokhtaria Drissi, Farah Chafika Kaouche, N. Medjahed, José Manuel Padrón, M. Debdab, M. Rahmouni, E. Belarbi","doi":"10.22146/ijc.87476","DOIUrl":"https://doi.org/10.22146/ijc.87476","url":null,"abstract":"This work focuses on synthesizing new imidazolin-4-one derivatives (2a-c), akin to leucettamine B analogs, via microwave-assisted transamination reactions. This reaction was carried out between 3-alkyl-5-dimethylamino-2-thioxo-imidazolidin-4-one (1a-c) and aniline. The structural integrity of the synthesized compounds was confirmed using NMR and MS spectroscopy, and their configurations were validated through DFT calculations. Analyses encompassed molecular electrostatic potential, frontier molecular orbitals, HOMO-LUMO energies, energy band gap, and global chemical reactivity descriptors, providing comprehensive insights into their characteristics. The investigation extended to the biological domain, employing substance activity spectra prediction (PASS) and molecular docking with Autodock Vina4 program. Notably, this holistic assessment aimed to gauge the potential regulatory effect of the compounds on cholesterol. This integrated approach contributes to compound design understanding and potential applications, spanning drug design and broader biomedical contexts.","PeriodicalId":13515,"journal":{"name":"Indonesian Journal of Chemistry","volume":null,"pages":null},"PeriodicalIF":0.9,"publicationDate":"2023-12-06","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"138983980","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Yosephine Novita Apriati, Bambang Kristiawan, Nikmatul Jannah, A. Nugraheni, S. Sholihun
Density functional theory calculations were performed to study the interactions between the host material Si-doped fullerene and the drug molecules paracetamol, a pain and fever reducer, and hydroxyurea, a drug for leukemic treatment. All atoms were relaxed so that the atomic force was less than 5.0 × 10−3 eV/Å. Structural and electronic properties, such as adsorption energy, formation energy, and charge transfer, were calculated. Results showed that Si-doped fullerene had more negative adsorption energy and lower formation energy than undoped fullerene, indicating that drug molecules could be chemisorbed in Si-doped fullerene. These results contribute to the future drug delivery application.
{"title":"Drug-Molecule Adsorption onto Silicon-Doped Fullerene: A Density Functional Theory Study","authors":"Yosephine Novita Apriati, Bambang Kristiawan, Nikmatul Jannah, A. Nugraheni, S. Sholihun","doi":"10.22146/ijc.84174","DOIUrl":"https://doi.org/10.22146/ijc.84174","url":null,"abstract":"Density functional theory calculations were performed to study the interactions between the host material Si-doped fullerene and the drug molecules paracetamol, a pain and fever reducer, and hydroxyurea, a drug for leukemic treatment. All atoms were relaxed so that the atomic force was less than 5.0 × 10−3 eV/Å. Structural and electronic properties, such as adsorption energy, formation energy, and charge transfer, were calculated. Results showed that Si-doped fullerene had more negative adsorption energy and lower formation energy than undoped fullerene, indicating that drug molecules could be chemisorbed in Si-doped fullerene. These results contribute to the future drug delivery application.","PeriodicalId":13515,"journal":{"name":"Indonesian Journal of Chemistry","volume":null,"pages":null},"PeriodicalIF":0.9,"publicationDate":"2023-12-06","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"138984322","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
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