Journal Description
Inorganics
Inorganics
is an international, scientific, peer-reviewed, open access journal on inorganic chemistry published monthly online by MDPI.
- Open Access— free for readers, with article processing charges (APC) paid by authors or their institutions.
- High Visibility: indexed within Scopus, SCIE (Web of Science), CAPlus / SciFinder, and other databases.
- Journal Rank: JCR - Q2 (Chemistry, Inorganic and Nuclear) / CiteScore - Q2 (Inorganic Chemistry)
- Rapid Publication: manuscripts are peer-reviewed and a first decision is provided to authors approximately 14.7 days after submission; acceptance to publication is undertaken in 2.8 days (median values for papers published in this journal in the first half of 2024).
- Recognition of Reviewers: reviewers who provide timely, thorough peer-review reports receive vouchers entitling them to a discount on the APC of their next publication in any MDPI journal, in appreciation of the work done.
- Testimonials: See what our authors say about Inorganics.
Impact Factor:
3.1 (2023);
5-Year Impact Factor:
2.6 (2023)
Latest Articles
Enhancing Thermochemical Energy Storage Performance of Perovskite with Sodium Ion Incorporation
Inorganics 2024, 12(10), 266; https://doi.org/10.3390/inorganics12100266 (registering DOI) - 11 Oct 2024
Abstract
Perovskite materials are promising for thermochemical energy storage due to their ability to undergo redox cycling over a wide temperature range. Although BaCoO3 exhibits excellent air cycling properties, its heat storage capacity in air remains suboptimal. This study introduces Na into the
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Perovskite materials are promising for thermochemical energy storage due to their ability to undergo redox cycling over a wide temperature range. Although BaCoO3 exhibits excellent air cycling properties, its heat storage capacity in air remains suboptimal. This study introduces Na into the lattice structure to enhance oxygen vacancy formation and mobility. DFT+U simulations of the surface structure of Na-doped BaCoO3−δ indicate that incorporating Na improves surface stability and facilitates the formation of surface oxygen vacancies. NaxBa1−xCoO3−δ compounds were synthesized using a modified sol–gel method, and their properties were investigated. The experimental results demonstrate that Na doping significantly enhances the redox activity of the material. The heat storage capacity increased by above 50%, with the Na0.0625Ba0.9375CoO3−δ solid solution achieving a heat storage density of up to 341.7 kJ/kg. XPS analysis reveals that Na doping increases the concentration of surface defect oxygen, leading to more active oxygen release sites at high temperatures. This enhancement in redox activity aligns with DFT predictions. During high-temperature cycling, the distribution of Na within the material becomes more uniform, and no performance degradation is observed after 300 cycles. Even after 450 cycles, Na0.0625Ba0.9375CoO3−δ retains over 96% of its initial redox activity, significantly outperforming fresh BaCoO3−δ. These findings elucidate the mechanism by which Na doping enhances the thermochemical heat storage performance of BaCoO3−δ and provide new insights for the design of perovskite-based materials.
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(This article belongs to the Section Inorganic Materials)
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Anion and Cation Dynamics in Mixed-Anion Hydroborate Na3(BH4)(B12H12): 1H, 11B, and 23Na NMR Studies
by
Olga A. Babanova, Yolanda Sadikin, Roman V. Skoryunov, Alexei V. Soloninin and Alexander V. Skripov
Inorganics 2024, 12(10), 265; https://doi.org/10.3390/inorganics12100265 - 8 Oct 2024
Abstract
Sodium borohydride-closo-hydroborate Na3(BH4)(B12H12) exhibits high room-temperature ionic conductivity and high electrochemical stability. To study the dynamical properties of this mixed-anion compound at the microscopic level, we have measured the 1H, 11B,
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Sodium borohydride-closo-hydroborate Na3(BH4)(B12H12) exhibits high room-temperature ionic conductivity and high electrochemical stability. To study the dynamical properties of this mixed-anion compound at the microscopic level, we have measured the 1H, 11B, and 23Na nuclear magnetic resonance spectra and nuclear spin-lattice relaxation rates over the temperature range of 8–573 K. Our 1H and 11B spin-lattice relaxation measurements have revealed two types of reorientational jump motion. The faster motional process attributed to reorientations of the [BH4]− anions is characterized by an activation energy of 159 meV, and the corresponding reorientational jump rate reaches ~108 s−1 near 130 K. The slower process ascribed to reorientations of the larger [B12H12]− anions is characterized by an activation energy of 319 meV, and the corresponding reorientational jump rate reaches ~108 s−1 near 240 K. The results of the 23Na nuclear magnetic resonance measurements are consistent with the fast long-range diffusion of Na+ ions in Na3(BH4)(B12H12). The diffusive jump rate of Na+ is found to reach ~104 s−1 at 300 K and ~8 × 108 s−1 at 530 K. A comparison of these jump rates with the ionic conductivity data suggests the importance of correlations between diffusing ions.
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(This article belongs to the Special Issue A Themed Issue in Honor of Prof. Radovan Cerny—Materials Science, Energy Storage, Diffraction and Crystal Chemistry)
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Recent Advances in Aluminum Nitride (AlN) Growth by Magnetron Sputtering Techniques and Its Applications
by
Nabeel Ahmad Khan Jadoon, Vaigunthan Puvanenthiram, Mayada Ahmed Hassan Mosa, Ashutosh Sharma and Kaiying Wang
Inorganics 2024, 12(10), 264; https://doi.org/10.3390/inorganics12100264 - 7 Oct 2024
Abstract
This review explores the processes involved in enhancing AlN film quality through various magnetron sputtering techniques, crucial for optimizing performance and expanding their application scope. It presents recent advancements in growing AlN thin films via magnetron sputtering, elucidating the mechanisms of AlN growth
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This review explores the processes involved in enhancing AlN film quality through various magnetron sputtering techniques, crucial for optimizing performance and expanding their application scope. It presents recent advancements in growing AlN thin films via magnetron sputtering, elucidating the mechanisms of AlN growth and navigating the complexities of thin-film fabrication. Emphasis is placed on different sputtering methods such as DC, RF, pulsed DC, and high-power impulse DC, highlighting how tailored sputtering conditions enhance film characteristics in each method. Additionally, the review discusses recent research findings showcasing the dynamic potential of these techniques. The practical applications of AlN thin films, including wave resonators, energy harvesting devices, and thermal management solutions, are outlined, demonstrating their relevance in addressing real-world engineering challenges.
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(This article belongs to the Special Issue Advanced Inorganic Semiconductor Materials, 2nd Edition)
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Open AccessArticle
Mesoporous Titania Nanoparticles for a High-End Valorization of Vitis vinifera Grape Marc Extracts
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Anil Abduraman, Ana-Maria Brezoiu, Rodica Tatia, Andreea-Iulia Iorgu, Mihaela Deaconu, Raul-Augustin Mitran, Cristian Matei and Daniela Berger
Inorganics 2024, 12(10), 263; https://doi.org/10.3390/inorganics12100263 - 3 Oct 2024
Abstract
Mesoporous titania nanoparticles (NPs) can be used for encapsulation polyphenols, with applications in the food industry, cosmetics, or biomedicine. TiO2 NPs were synthesized using the sol-gel method combined with solvothermal treatment. TiO2 NPs were characterized through X-ray diffraction, FTIR spectroscopy, the
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Mesoporous titania nanoparticles (NPs) can be used for encapsulation polyphenols, with applications in the food industry, cosmetics, or biomedicine. TiO2 NPs were synthesized using the sol-gel method combined with solvothermal treatment. TiO2 NPs were characterized through X-ray diffraction, FTIR spectroscopy, the N2 adsorption method, scanning and transmission electron microscopy, and thermal analysis. The sample prepared using Pluronic F127 presented a higher surface area and less agglomerated NPs than the samples synthesized with Pluronic P123. Grape marc (GM), a by-product from wine production, can be exploited for preparing extracts with good antioxidant properties. In this regard, we prepared hydroethanolic and ethanolic GM extracts from two cultivars, Feteasca Neagra (FN) and Pinot Noir. The extract components were determined by spectrometric analyses and HPLC. The extract with the highest radical scavenging activity, the hydroethanolic FN extract, was encapsulated in titania (FN@TiO2) and compared with SBA-15 silica support. Both resulting materials showed biocompatibility on the NCTC fibroblast cell line in a 50–300 µg/mL concentration range after 48 h of incubation and even better radical scavenging potential than the free extract. Although titania has a lower capacity to host polyphenols than SBA-15, the FN@TiO2 sample shows better cytocompatibility (up to 700 µmg/mL), and therefore, it could be used for skin-care products.
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(This article belongs to the Special Issue New Advances into Nanostructured Oxides, 2nd Edition)
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Investigating the Shape Memory Effect and Corrosion Resistance of the Fe-(17-2x) Mn-6Si-xNi-yCr-0.3C Alloys (x = 0, 1, 2, 3, 4; y = 0, 1, 3, 5)
by
Aqeel Abbas, Kai-Cheng Chang, Kun-Ming Lin and Hsin-Chih Lin
Inorganics 2024, 12(10), 262; https://doi.org/10.3390/inorganics12100262 - 30 Sep 2024
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In this study, low Mn content Fe-Mn-Si-based shape memory alloys [Fe-(17-2x) Mn-6Si-xNi-yCr-0.3C (x = 0, 1, 2, 3, 4; y = 0, 1, 3, 5)] were prepared via vacuum arc remelting. The alloys were hot-rolled and solid-solution-treated at 1150 °C for 1 h
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In this study, low Mn content Fe-Mn-Si-based shape memory alloys [Fe-(17-2x) Mn-6Si-xNi-yCr-0.3C (x = 0, 1, 2, 3, 4; y = 0, 1, 3, 5)] were prepared via vacuum arc remelting. The alloys were hot-rolled and solid-solution-treated at 1150 °C for 1 h followed by aging at elevated temperatures. The effects of Cr and Ni addition on the shape memory performance and corrosion resistance of the alloys in 3.5 wt% NaCl solutions were investigated using bending test and potentiodynamic polarization, respectively. It was revealed that the recoverable strain of the alloys remains larger than 2% when 1Ni is replaced with 2Mn and Cr is added. However, it becomes less than 2% in 11Mn and 9Mn alloys because of the easy formation of the α’ martensite. The shape memory effect of alloys is highly improved due to the precipitation of fine carbides in the grains by the addition of Cr and after aging treatment at elevated temperatures (≧700 °C). The highest shape recovery ratios of 88.3% for 17Mn0Ni3Cr, 94.0% for 15Mn1Ni3Cr, 94.4% for 13Mn2Ni5Cr, 88.1% for 11Mn3Ni5Cr, and 86.8% for 9Mn4Ni7Cr, respectively, were achieved after 800 °C aging treatment. The strip-like second phase (carbides) forms at the grain boundaries in the Cr-free alloys after 600 °C aging treatment. There are lots of fine carbides (M23C6 and M7C3) precipitated in the interior of the grains at the aging treatments ≧ 700 °C. However, M7C3 is eliminated at 900 °C aging treatment. The corrosion resistance results showed that the corrosion resistance of the alloys is improved by adding Cr. The maximum corrosion potentials (−0.474 V) have been observed for 13Mn2Ni5Cr, and similar mechanisms have been analyzed in all series of alloys.
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Open AccessArticle
Synthesis and Characterization of New Copper(II) Coordination Compounds with Methylammonium Cations
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Amalija Golobič, Brina Dojer, Marko Jagodič, Anja Siher, Anže Pegan and Matjaž Kristl
Inorganics 2024, 12(10), 261; https://doi.org/10.3390/inorganics12100261 - 29 Sep 2024
Abstract
We synthesized four new copper(II) complexes with acetato and chlorido ligands and methylammonium (MA), dimethylammonium (DMA), and tetramethylammonium (TMA) counterions: (MA)4[Cu2Ac4Cl2]Cl2·2H2O (1), (DMA)2[Cu2Ac4Cl
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We synthesized four new copper(II) complexes with acetato and chlorido ligands and methylammonium (MA), dimethylammonium (DMA), and tetramethylammonium (TMA) counterions: (MA)4[Cu2Ac4Cl2]Cl2·2H2O (1), (DMA)2[Cu2Ac4Cl2] (2), (DMA)4[Cu2Ac4Cl2]Cl2·2H2O (3), and (TMA)5[Cu2Ac4Cl]Cl4·4H2O (4). All compounds were characterized by single-crystal X-ray diffraction, magnetic measurements, FTIR spectroscopy, and thermogravimetric analysis. Complexes 1, 2, and 3 consist of a dinuclear coordination anion [Cu2(Ac)4Cl2]2− with bridging acetato ligands arranged in a paddle-wheel conformation and square-pyramidal coordination around Cu(II) atoms, while the coordination anion in compound 4 is a polymeric chain, parallel to the c axis, with Cu2(Ac)4 units connected through bridging chlorido ligands. Magnetic measurements carried out between 2 K and 300 K indicate strong antiferromagnetic interactions between Cu(II) ions. The effective magnetic moments range from to , exceeding the spin-only value for Cu(II) ions ( ) and suggesting significant orbital contributions to the magnetic moment. Thermogravimetric analysis of all complexes showed a multistep decomposition behavior yielding elemental copper as the final product.
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(This article belongs to the Section Coordination Chemistry)
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Dithiodipropionate and Fumarate Ni, Cu, and Zn Mixed Ligand Complexes
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Ivana Loubalová, Kamil Kotrle, Peter Antal, Lucie Hochvaldová, Aleš Panáček, Ivana Císařová, Marcin Świątkowski and Pavel Kopel
Inorganics 2024, 12(10), 260; https://doi.org/10.3390/inorganics12100260 - 28 Sep 2024
Abstract
Three nickel, copper, and zinc complexes with dicarboxylic acids (3,3′-dithiodipropionic acid (H2dtdp) and fumaric acid (H2fu)) and N-donor ligands (1,10-phenanthroline (phen), N′–methyldipropylenetriamine (mdpta), and N,N,N′,N″,N″-pentamethyldiethylenetriamine (pmdien)) were synthesized.
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Three nickel, copper, and zinc complexes with dicarboxylic acids (3,3′-dithiodipropionic acid (H2dtdp) and fumaric acid (H2fu)) and N-donor ligands (1,10-phenanthroline (phen), N′–methyldipropylenetriamine (mdpta), and N,N,N′,N″,N″-pentamethyldiethylenetriamine (pmdien)) were synthesized. These complexes were characterized using elemental analysis, IR spectroscopy, and single-crystal X-ray diffraction. Interestingly, [Ni(dtdp)(phen)(H2O)3]∙0.5H2O (1) is a mononuclear complex, where the dtdp dianion employs only one carboxylate group for coordination to the central nickel atom. [(ClO4)(mdpta)Cu(μ-dtdp)Cu(mdpta)(H2O)](ClO4) (2) is a dinuclear copper complex with a dtdp bridge and different coordination on the copper center. [{Zn(pmdien)(H2O)}2(μ-fu)](ClO4)2 (3) is a symmetric dimer with a bridging fumarate ligand. These coordination compounds were tested for their antibacterial activities on Escherichia coli, Pseudomonas aeruginosa, Staphylococcus aureus, and Enterococcus faecalis bacteria strains. All the complexes show moderate activities on the mentioned strains.
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(This article belongs to the Section Coordination Chemistry)
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Coupled Transport of Metal Ions in Aqueous Solutions Containing NaCl and HCl
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M. Melia Rodrigo, Filipa R. L. Fernandes, Sónia I. G. Fangaia, Almudena Crespo, Ana C. F. Ribeiro and Miguel A. Esteso
Inorganics 2024, 12(10), 259; https://doi.org/10.3390/inorganics12100259 - 27 Sep 2024
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The main objective of this work was to analyze the transport by diffusion of salts containing some metal ions (that is, CoCl2, CrCl3, HgCl2, and PbCl2), at 25.0 °C, in two different aqueous solutions with
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The main objective of this work was to analyze the transport by diffusion of salts containing some metal ions (that is, CoCl2, CrCl3, HgCl2, and PbCl2), at 25.0 °C, in two different aqueous solutions with varying pH levels, namely, sodium chloride and hydrochloric chloride, by using Nernst–Hartley model equations. To analyze the applicability of this model, experimental data for two aqueous systems (CoCl2 + NaCl) and (CoCl2 + HCl), were obtained by using the Taylor technique and compared with the predicted values. The Nernst–Hartley model equations were used in this study to estimate the mutual diffusion coefficients of the eight ternary systems, which included (CoCl2 + NaCl), (HgCl2 + NaCl), (PbCl2 + NaCl), (CrCl3 + NaCl), and (CoCl2 + HCl), (HgCl2 + HCl), (PbCl2 + HCl), and (CrCl3 + HCl). By using the limiting equations of Nernst–Hartley coefficients, we were able to understand the composition dependence of the mutual diffusion coefficients of these mixed electrolyte solutions and the electrostatic mechanism for the strongly coupled diffusion of these components.
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Open AccessArticle
Antimicrobial, Optical, and Mechanical Properties of Saliva-Contaminated Silver–Zeolite Nanoparticle-Incorporated Dental Acrylic Resins
by
Çisel Kısa Yaman, Necla Demir, Uğur Arslan and Nurullah Çiftçi
Inorganics 2024, 12(10), 258; https://doi.org/10.3390/inorganics12100258 - 25 Sep 2024
Abstract
Background and Purpose: This study aimed to evaluate the flexural strength, color change and antimicrobial effect of silver–zeolite nanoparticles (NPs) in acrylic resin materials. Methods: Fifty-six disc-shaped acrylic resin samples were divided into four groups (n = 7) according to concentrations of
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Background and Purpose: This study aimed to evaluate the flexural strength, color change and antimicrobial effect of silver–zeolite nanoparticles (NPs) in acrylic resin materials. Methods: Fifty-six disc-shaped acrylic resin samples were divided into four groups (n = 7) according to concentrations of silver–zeolite NPs (0%, 2%, 4%, 5%). Discs were contaminated with C. albicans and S. mutans. The antimicrobial effect was tested by inoculating contaminated discs on Tryptic soy agar (TSA), Sabouraud Dextrose Agar (SDA), Tryptic soy broth (TSB), and Sabouraud dextrose broth (SDB). Forty rectangular 65 × 10 × 2.5 mm acrylic resin specimens were also classified into four groups (n = 10) according to concentrations of silver–zeolite NPs. For the color change, L, a, and b values of rectangular specimens were examined with a spectrophotometer. A three-point bending test was also performed using a Devotrans device to determine the flexural bond strength of rectangular specimens. Scanning electron microscope analysis (SEM/EDX analysis) was also performed. Results: In this study, the antimicrobial effect increased with the concentration of silver–zeolite NPs added to acrylic resin discs. In our study, adding 2% silver–zeolite NPs was more effective against C. albicans. The antimicrobial effect against S. mutans increased with concentration of silver–zeolite NPs (<0.001). The colonization of C. albicans was significantly reduced by silver–zeolite NPs. A significant increase was observed in the color change as the nanoparticle percentage ratio increased (p < 0.001). The flexural strength values of the groups containing 2% and 4% nanoparticles were found to be clinically acceptable. Conclusions: The study showed that bacterial and fungal colonization is significantly reduced by adding silver–zeolite nanoparticles to acrylic resin discs. Based on its antimicrobial, physical, and mechanical properties, we recommend adding 2% silver–zeolite nanoparticles to the acrylic resin material for optimal results.
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(This article belongs to the Special Issue Functional Inorganic Biomaterials for Molecular Sensing and Biomedical Applications)
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Open AccessReview
Charge Traps in Wide-Bandgap Semiconductors for Power Electronics Applications
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Kean Chuan Lee and Martin Weis
Inorganics 2024, 12(10), 257; https://doi.org/10.3390/inorganics12100257 - 24 Sep 2024
Abstract
Wide-bandgap semiconductors have been envisioned for power electronics applications because of their ability to operate at higher temperatures and higher applied voltages without breakdown. However, the presence of defects may cause device failure, necessitating a comprehensive understanding of material defects. This review provides
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Wide-bandgap semiconductors have been envisioned for power electronics applications because of their ability to operate at higher temperatures and higher applied voltages without breakdown. However, the presence of defects may cause device failure, necessitating a comprehensive understanding of material defects. This review provides a fingerprint of known defects in three envisioned semiconductors for power electronics: 4H-SiC, GaN, and β-Ga2O3. Via a detailed discussion of defects—the origins of electrically active charge traps—through their activation energies and capture cross-sections, we provide important insights into defect parameter distributions. This review not only serves as a reference but also offers a strategic roadmap for distinguishing between similar defects. Such knowledge is key for the development of more robust and efficient power electronic devices that can fully exploit the potential of wide-bandgap semiconductors.
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(This article belongs to the Section Inorganic Materials)
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Multistimuli Luminescence and Anthelmintic Activity of Zn(II) Complexes Based on 1H-Benzimidazole-2-yl Hydrazone Ligands
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Alexey Gusev, Elena Braga, Alexandr Kaleukh, Michail Baevsky, Mikhail Kiskin and Wolfgang Linert
Inorganics 2024, 12(9), 256; https://doi.org/10.3390/inorganics12090256 - 23 Sep 2024
Abstract
Three novel Zn(II) mononuclear complexes with the general formula ZnL2Cl2 (L = 2-(4-R-phenylmethylene)benzimidazol-2-hydrazines; R-H (1), R-CH3 (2), and R-OCH3 (3)) were synthesized and fully characterized by various means. These complexes demonstrate excitation-dependent emission, which is detected by a
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Three novel Zn(II) mononuclear complexes with the general formula ZnL2Cl2 (L = 2-(4-R-phenylmethylene)benzimidazol-2-hydrazines; R-H (1), R-CH3 (2), and R-OCH3 (3)) were synthesized and fully characterized by various means. These complexes demonstrate excitation-dependent emission, which is detected by a change in the emission color (from blue to green) upon an increase in the excitation wavelength. Moreover complex 1 shows reversible mechanochromic luminescence behavior due to the reversible loss of solvated methanol molecules upon the intense grinding of crystals. In addition, 1 exhibits vapochromic properties, which originate from the adsorption methanol vapor on the crystal surface. The strengthening of anthelmintic activity at the transition from free hydrazones to zinc-based complexes is shown.
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(This article belongs to the Section Coordination Chemistry)
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An Investigation of Lanthanum Recovery from an Aqueous Solution by Adsorption (Ion Exchange)
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Michael Chan, Huu Doan and Trong Dang-Vu
Inorganics 2024, 12(9), 255; https://doi.org/10.3390/inorganics12090255 - 23 Sep 2024
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Lanthanum (La(III)) is one of the high-demand rare earth elements with applications in various products. However, La(III) in mining waste streams and electronic waste also poses environmental and health concerns. Therefore, the recovery of La(III) in the waste is needed. In the present
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Lanthanum (La(III)) is one of the high-demand rare earth elements with applications in various products. However, La(III) in mining waste streams and electronic waste also poses environmental and health concerns. Therefore, the recovery of La(III) in the waste is needed. In the present study, the adsorption of La(III) with Dowex 50W-X8, Amberchrom50WX4, Amberlyst 15, and Amberchrom 50WX2 was evaluated using a shaker water bath. Dowex 50W-X8 was found to be the best adsorbent and was used to investigate the effect of the shaker speed (RPM = 50–150), adsorbent dosage (1.0–4.0 g), pH (2.0–7.0), and temperature (20–40 °C) on adsorption. La(III) adsorption was found to increase with the shaker speed, as expected. On the other hand, the adsorption capacity decreased with the adsorbent amount. Also, the highest La(III) adsorption was observed at pH = 6.0. La(III) percentage removal did not vary significantly with a temperature from 20 °C to 40 °C. However, the first-order kinetic rate constant decreased moderately with increases in temperature. The adsorption of La(III) by Dowex 50-X8 followed the Freundlich isotherm model better than the Langmuir model. In addition, the adsorption kinetics were represented well by the pseudo-first-order kinetic model. Moreover, enthalpy and Gibbs free energy changes were found to be negative, indicating an exothermic and thermodynamically favorable adsorption process.
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Open AccessArticle
Novel Tricarbonylrhenium-Anthrapyrazole Complexes with DNA-Binding and Antitumor Properties: In Vitro and In Vivo Pharmacokinetic Studies with 99mTc-Analogue
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Georgios Paparidis, Melpomeni Akrivou, George Psomas, Ioannis S. Vizirianakis, Antonios Hatzidimitriou, Catherine Gabriel, Dimosthenis Sarigiannis and Dionysia Papagiannopoulou
Inorganics 2024, 12(9), 254; https://doi.org/10.3390/inorganics12090254 - 21 Sep 2024
Abstract
Organometallic complexes of fac-tricarbonylrhenium have been shown to exhibit anticancer properties. Anthrapyrazole anticancer agents act as DNA intercalators and topoisomerase IIα inhibitors, leading to double-strand breaks (DBS) and cell cycle arrest. This work involves the synthesis and biological evaluation of novel fac
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Organometallic complexes of fac-tricarbonylrhenium have been shown to exhibit anticancer properties. Anthrapyrazole anticancer agents act as DNA intercalators and topoisomerase IIα inhibitors, leading to double-strand breaks (DBS) and cell cycle arrest. This work involves the synthesis and biological evaluation of novel fac-tricarbonyl-rhenium complexes with anthrapyrazole derivatives. The anthrapyrazole moiety was synthesized from 1,8-dihydroxyanthraquinone, and three ligands L1, L2 and L3 were prepared. Ligand L1 coordinates via the phenolic O and pyrazole N as bidentate chelator forming the fac-[Re(CO)3(κ2-N,O)(MeOH)]-type complex, ReL1. Ligand L2 contains a pendant picolylamine N,N′-chelating system, forming the bidentate fac-[Re(CO)3(κ2-N,N′)Br]-type complex, ReL2. Ligand L3 contains a pendant picolylaminomonoacetic acid chelating system, forming a tridentate fac-[Re(CO)3(κ3-N,N′,O)]-type complex, ReL3. Complex ReL4 contains a picolylamine chelator, forming a complex with structure fac-[Re(CO)3(κ2-N,N′)Br], which was synthesized as a model for ReL2, and its coordination mode was resolved by X-ray crystallography. The complexes were characterized spectroscopically, and their biological properties were evaluated in vitro, in terms of DNA binding as well as for the cytotoxicity against CT-26 tumor cell line. Tumor cell cytotoxicity was high for ligand L2 and complex ReL2, exhibiting IC50 values of 0.36 and 0.64 μΜ, respectively. The most promising complex ReL2 was evaluated further by the preparation of its congener γ-emitting technetium-99m radio-complex, 99mTcL2. The in vitro uptake in CT26 tumor cells and the in vivo uptake in CT26 tumor-bearing mice of 99mTcL2 was determined, and its pharmacokinetic profile was established. These data indicate that the 99mTc complex has suitable properties to enter tumor cells in vitro and in vivo, and therefore ReL2 is promising for further evaluation.
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(This article belongs to the Special Issue Biological Activity of Metal Complexes)
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Preventing Dental Caries with Calcium-Based Materials: A Concise Review
by
Jieyi Chen, Yuqing Zhang, Iris Xiaoxue Yin, Ollie Yiru Yu, Alice Kit Ying Chan and Chun Hung Chu
Inorganics 2024, 12(9), 253; https://doi.org/10.3390/inorganics12090253 - 19 Sep 2024
Abstract
This concise review provides an update on the use of calcium-based materials for the prevention of dental caries. Some calcium-based materials promote remineralization and neutralize bacterial acids, disrupting cariogenic biofilms and inhibiting bacterial growth. Medical Subject Headings of [Dental Caries] and [Calcium] were
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This concise review provides an update on the use of calcium-based materials for the prevention of dental caries. Some calcium-based materials promote remineralization and neutralize bacterial acids, disrupting cariogenic biofilms and inhibiting bacterial growth. Medical Subject Headings of [Dental Caries] and [Calcium] were adopted to search publications. Information related to the aim of this review was extracted and summarized. Common calcium-based materials are calcium phosphate, hydroxyapatite, calcium carbonate, calcium fluoride and casein phosphopeptide–amorphous calcium phosphate (CPP-ACP). Calcium phosphate is commonly used in toothpaste. It provides calcium and phosphate ions, enhances the incorporation of fluoride into caries lesions and increases mineral density. Hydroxyapatite is a form of calcium phosphate that is chemically similar to the mineral found in teeth. It can be applied on teeth to prevent caries. Calcium carbonate can be found in toothpastes. It neutralizes bacterial acids and acts as a calcium reservoir during remineralization. Calcium fluoride is found in dental products and promotes remineralization as a source of fluoride, which can be incorporated into tooth enamel, forming fluorapatite and increasing resistance to caries. CPP-ACP is derived from milk proteins. It contains calcium and phosphate, which help to remineralize tooth enamel. CPP-ACP inhibits cariogenic bacteria. It also interacts with bacterial biofilms and disrupts their formation. These calcium-based materials can be used to boost the preventive effect of fluorides or, alternatively, as a therapy for caries prevention.
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(This article belongs to the Special Issue Recent Research and Application of Amorphous Materials)
Open AccessArticle
Portable Electrochemical Immunosensor Based on a Gold Microblobs-Optimized Screen-Printed Electrode for SARS-CoV-2 Diagnosis
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Melissa M. Giacomet, Paulo H. M. Buzzetti, Oscar O. S. Junior, Alessandro F. Martins, Elton G. Bonafe and Johny P. Monteiro
Inorganics 2024, 12(9), 252; https://doi.org/10.3390/inorganics12090252 - 18 Sep 2024
Abstract
The development of biosensors for determining the most diverse biomolecules is a constant focus of many research groups. There is a latent need to propose sensors that combine portability, simple measurements, and good analytical performance. Here, we propose an electrochemical immunosensor that is
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The development of biosensors for determining the most diverse biomolecules is a constant focus of many research groups. There is a latent need to propose sensors that combine portability, simple measurements, and good analytical performance. Here, we propose an electrochemical immunosensor that is fully portable and energy-independent for diagnosing antibodies against SARS-CoV-2 (the virus that causes COVID-19). Initially, disposable screen-printed carbon electrodes (SPEs) were covered by gold microblobs (AuMBs), which were synthesized amperometrically from Au3+ ions. Then, the SPE-AuMBs were coated with cysteamine, which allowed the N-hydroxysuccinimide-activated SARS-CoV-2 antigen (spike protein) to be immobilized. The antigen-activated electrode was used to detect COVID-19 antibodies from current measurements obtained by differential pulse voltammetry. The AuMBs synthesis time was optimized, and the presence of gold structures improved the electrochemical responses of the SPE. It was possible to quantitatively determine antibodies in the concentration range of 0.25 to 10 µg mL−1. This range includes concentrations found in biological fluids from patients at any stage of the disease. An analysis took approximately the same time as traditional rapid nasal tests (20 min) and costed less, considering all the steps necessary to prepare a disposable antigen-functionalized SPE.
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(This article belongs to the Special Issue Functional Inorganic Biomaterials for Molecular Sensing and Biomedical Applications)
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Theoretical Study of the Effects of Different Coordination Atoms (O/S/N) on Crystal Structure, Stability, and Protein/DNA Binding of Ni(II) Complexes with Pyridoxal-Semi, Thiosemi, and Isothiosemicarbazone Ligand Systems
by
Violeta Jevtovic, Aleksandra Rakić, Odeh A. O. Alshammari, Munirah Sulaiman Alhar, Tahani Alenezi, Violeta Rakic and Dušan Dimić
Inorganics 2024, 12(9), 251; https://doi.org/10.3390/inorganics12090251 - 17 Sep 2024
Abstract
Nickel transition metal complexes have shown various biological activities that depend on the ligands and geometry. In this contribution, six Ni(II) nitrate complexes with pyridoxal-semi, thiosemi, and isothiosemicarbazone ligands were examined using theoretical chemistry methods. The structures of three previously reported complexes ([Ni(PLSC)(H
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Nickel transition metal complexes have shown various biological activities that depend on the ligands and geometry. In this contribution, six Ni(II) nitrate complexes with pyridoxal-semi, thiosemi, and isothiosemicarbazone ligands were examined using theoretical chemistry methods. The structures of three previously reported complexes ([Ni(PLSC)(H2O)3]∙2NO3−, [Ni(PLTSC)2] ∙2NO3−∙H2O, and [Ni(PLITSC)(H2O)3]∙2NO3−) were investigated based on Hirshfeld surface analysis, and the most important stabilization interactions in the crystal structures were outlined. These structures were optimized at the B3LYP/6-311++G(d,p)(H,C,N,O,(S))/LanL2DZ(Ni) level of theory, and the applicability was checked by comparing theoretical and experimental bond lengths and angles. The same level of theory was applied for the optimization of three additional structures, ([Ni(PLSC)2]2+, [Ni(PLTSC)(H2O)3]2+, and [Ni(PLITSC)2]2+). The interactions between selected ligands and Ni(II) were examined using the Natural Bond Orbital (NBO) and Quantum Theory of Atoms in Molecules (QTAIM) approaches. Particular emphasis was placed on interactions between oxygen, sulfur, and nitrogen donor atoms and Ni(II). Human Serum Albumin (HSA) and the DNA-binding properties of these complex cations were assessed using molecular docking simulations. The presence of water molecules and various substituents in the thermodynamics of the processes was demonstrated. The results showed significant effects of structural parameters on the stability and reactivity towards important biomolecules.
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(This article belongs to the Special Issue Metal Complexes Diversity: Synthesis, Conformations, and Bioactivity)
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Research on Modification of Oxygen-Producing Adsorbents for High-Altitude and Low-Pressure Environments
by
Ye Li, Huiqing Yue, Quanli Zhang, Dumin Yan, Ziyi Li, Zhiwei Liu, Yingshu Liu, Yongyan Wang, Shifeng Wang and Xiong Yang
Inorganics 2024, 12(9), 250; https://doi.org/10.3390/inorganics12090250 - 14 Sep 2024
Abstract
In oxygen production on plateaus, pressure swing adsorption (PSA) oxygen production is currently the most commonly used oxygen production method. In plateau regions, low pressure leads to a decrease in adsorbent nitrogen–oxygen separation performance, which affects the performance of PSA oxygen production, so
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In oxygen production on plateaus, pressure swing adsorption (PSA) oxygen production is currently the most commonly used oxygen production method. In plateau regions, low pressure leads to a decrease in adsorbent nitrogen–oxygen separation performance, which affects the performance of PSA oxygen production, so it is particularly important to enhance adsorbent nitrogen–oxygen separation performance. In this paper, Li-LSX (lithium low-silicon aluminum X zeolite molecular sieve) adsorbents were modified using the liquid phase ion exchange method, and five kinds of modified adsorbents were obtained, namely AgLi-LSX, CaLi-LSX, ZnLi-LSX, CuLi-LSX, and FeLi-LSX, respectively. The influences of different metal ions and modification time lengths on the adsorbent nitrogen adsorption and nitrogen–oxygen separation coefficients were analyzed. Through theoretical calculations, the nitrogen and oxygen adsorption and separation performances of the modified adsorbents at different altitudes and low adsorption pressures were investigated. It is shown that the nitrogen adsorption capacity of the AgLi-LSX-1 adsorbent obtained from the modification experiment reaches 27.92 mL/g, which is 3.24 mL/g higher than that of Li-LSX; the nitrogen–oxygen separation coefficients of S1 and S2 are 19.24 and 7.54 higher, respectively; and the nitrogen–oxygen separation coefficients of S4 are 20.85 and 7.54 higher than those of Li-LSX, respectively. With the increase in altitude from 50 m to 5000 m, the nitrogen–oxygen separation coefficient of the AgLi-LSX-1 adsorbent increased rapidly from 20.85 to 57, and its nitrogen–oxygen separation coefficient S4 exceeded that of the Li-LSX adsorbent to reach 47.61 at an altitude of 4000 m. Therefore, the modified adsorbent AgLi-LSX-1 in this paper can enhance the performance of the PSA oxygen process for oxygen production in plateau applications.
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(This article belongs to the Special Issue Inorganic Composites for Gas Separation)
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Recent Advances in Biological and Catalytic Applications of Metal Complexes
by
Jose Manuel Mendez-Arriaga
Inorganics 2024, 12(9), 249; https://doi.org/10.3390/inorganics12090249 - 13 Sep 2024
Abstract
The use of metals in biological [...]
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(This article belongs to the Special Issue Recent Advances in Biological and Catalytic Applications of Metal Complexes)
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NMR-Based Structural Insights on Folic Acid and Its Interactions with Copper(II) Ions
by
Arian Kola and Daniela Valensin
Inorganics 2024, 12(9), 248; https://doi.org/10.3390/inorganics12090248 - 12 Sep 2024
Abstract
Folic acid (FA) is an essential vitamin involved in crucial metabolic processes, while copper(II) ions play significant roles in various biological functions. This study aims to investigate the interaction between FA and Cu2+ using 1H and 13C NMR spectroscopy
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Folic acid (FA) is an essential vitamin involved in crucial metabolic processes, while copper(II) ions play significant roles in various biological functions. This study aims to investigate the interaction between FA and Cu2+ using 1H and 13C NMR spectroscopy under different pH levels and concentrations. The research employed detailed NMR analysis to explore how Cu2+ binds to FA, focusing on changes in chemical shifts, diffusion coefficients, and copper-induced paramagnetic effects. The key findings reveal that Cu2+ predominantly coordinates with the pteridine ring (PTE) of FA, with minimal involvement from the glutamic acid (Glu) moiety. The interaction is strongly concentration-dependent: at lower FA concentrations, Cu2+ binds effectively to the PTE ring, while at higher concentrations, intermolecular interactions among FA molecules hinder copper binding. The study also observed pronounced paramagnetic effects on the PTE and p-aminobenzoic acid protons, with negligible effects on Glu signals. These results provide new insights into the structural characteristics of FA-Cu2+ complexes, contributing to a better understanding of their biochemical interactions and implications for folate metabolism.
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(This article belongs to the Special Issue Women’s Special Issue Series: Inorganics)
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Synthesis and Study of Correlated Phase Transitions of CrN Nanoparticles
by
Khan Alam
Inorganics 2024, 12(9), 247; https://doi.org/10.3390/inorganics12090247 - 11 Sep 2024
Abstract
Chromium nitride is an important transition metal nitride for studying fundamental properties and for advanced technological applications. It is considered a model system for exploring structural, electronic, and magnetic transitions. These transitions occur at 275 ± 10 K and appear to be coupled;
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Chromium nitride is an important transition metal nitride for studying fundamental properties and for advanced technological applications. It is considered a model system for exploring structural, electronic, and magnetic transitions. These transitions occur at 275 ± 10 K and appear to be coupled; however, many discrepant studies on these transitions can be found in the published literature. The underlying reasons for these controversies are suspected to be the CrN nanoparticles preparation methods, strains, impurities, stoichiometry, nanoparticle size, characterization methods, and ambient conditions for characterizing them. This article is focused on the review of the nanoparticle synthesis methods and the use of these nanoparticles for studying structural, electronic, and magnetic transitions. The focus is mainly on the experimental methods, while theoretical simulations are briefly reviewed at the end of the article.
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(This article belongs to the Special Issue Advanced Inorganic Semiconductor Materials, 2nd Edition)
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