The actual drasticCopper alkynyl complexes [CuAg3(C[triple connection, duration as m-dash]CAr)3(PPh3)3]+ (Ar = Ph, p-C6H4Me), where a few Ag(PPh3) products are destined amongst a few C[triple connect, period because m-dash]CAr biceps associated with trigonal-planar [Cu(C[triple bond, length as m-dash]CAr)3]2-, were chosen as being a safeguarding device to hide the particular metal central associated with an atomically accurate core-shell-type bunch. 1st, the formation of the guarding device over the result of Cu(NCMe)Several(PF6) together with Ag(C[triple connect hepatitis virus , period because m-dash]CAr) and also PPh3 in the 1  3  3 ratio has been validated. The reaction presented dimeric [CuAg3(C[triple connect, period as BYL719 m-dash]CAr)Several(PPh3)3]22+, when the two planar [CuAg3(C[triple relationship, period as m-dash]CAr)3(PPh3)3]+ units were placed. Up coming, core-shell-type groupings have been created by adding NaBH4 and also Et4NX (Times Equates to Craigslist, Bedroom) to some solution similar to that will utilized to make your safeguarding device. The particular trigonal-planar safeguarding devices effectively formed core-shell-type Ag nanoclusters designed Bioactivity of flavonoids as [Ag13H8X6CuAg3(C[triple bond, length as m-dash]CAr)3(C-term magnetic circular dichroism (MCD) spectroscopy is a powerful method for probing d-d and f-f transitions in paramagnetic metal complexes. However, this technique remains underdeveloped both experimentally and theoretically for studies of U(v) complexes of Oh symmetry, which have been of longstanding interest for probing electronic structure, bonding, and covalency in 5f systems. In this study, C-term NIR MCD of the Laporte forbidden f-f transitions of [UCl6]- and [UF6]- are reported, demonstrating the significant fine structure resolution possible with this technique including for the low energy Γ7 → Γ8 transitions in [UF6]-. The experimental NIR MCD studies were further extended to [U(OC6F5)6]-, [U(CH2SiMe3)6]-, and [U(NC(tBu)(Ph))6]- to evaluate the effects of ligand-type on the f-f MCD fine structure features. Theoretical calculations were conducted to determine the Laporte forbidden f-f transitions and their MCD intensity experimentally observed in the NIR spectra of the U(v) hexahalide complexes, vThe thermodynamic (PCN-222) and kinetic (PCN-224) products of porphyrinic Zr-metal-organic frameworks (MOFs) were synthesized via an anodic dissolution approach for the first time. To the best of our knowledge, this is the first report of MOF polymorphs being controlled by electrolysis. The selective formation of PCN-222 requires an amorphous component to be present on the electrode during the initial reaction process.Here, Au@mSiO2 core-shell nanoparticles were easily synthesized by a one-pot method. Positively charged alkyl chains with different lengths were modified on the surface of the particles. Thus composite nanoparticles with different potentials and hydrophilic interface properties were prepared. Based on the charge properties of the shell surface, the process of loading dyes was simplified by the strong electrostatic adsorption between the particle surface and the heterogeneous negatively charged dyes. The fluorescence intensity and fluorescence lifetime of the loaded fluorescent dyes showed that the dyes could not produce effective tunneling in the mesoporous materials, which was limited to the surface of the particles, which is beneficial for the subsequent research on the loading or release of nanoparticles. After loading, the nanoparticles still exhibit a high fluorescence intensity, enabling dual-mode microscopic imaging (TEM and fluorescence).This paper reports chiral mixed Eu(iii)-Ln(iii) coordination polymers (Ln = Gd and Sm) with a high dissymmetry factor of circularly polarized luminescence (gCPL = 0.15) for the enhancement of the emission quantum yield (Φtot ≥ 50%), achieved via control of 4f electronic structures.We report a series of structurally related Gd(iii) complexes designed to modulate the exchange of the coordinated water molecule, which is an important parameter to be controlled to achieve optimal performance of contrast agents for application in magnetic resonance imaging (MRI). The ligands contain a DO3A scafold functionalised with 2′-methoxyphenacyl or 4′-methoxyphenacyl groups (DO3A-oMAP and DO3A-pMAP), a 2′-aminophenacyl group (DO3A-oAnAP) or a 2′,4′-dihydroxyphenacyl moiety (DO3A-DiHAP). The results are compared with those obtained previously for the analogues containing 2′- or 4′-hydroxyphenacyl groups (DO3A-oHAP and DO3A-pHAP, respectively) and the parent system with an unsubstituted acetophenone pendant arm (DO3A-AP). 1H NMR studies performed on the Eu(iii) complexes show that ligand functionalisation causes a very minor effect on the relative populations of the SAP and TSAP isomers present in solution, with the SAP isomer representing 70-80% of the overall population. The emission spectra of the EuMn(iii) complexes with achiral ligands, (E)-N-(2-((2-aminobenzylidene)amino)-2-methylpropyl)-5-X-2-hydroxybenzamide (HLX, X = H, Cl, Br, and I), crystallise as chiral conglomerates containing amide oxygen-bridged one-dimensional coordination polymers that exhibit weak ferromagnetism. The bulk products exhibit symmetry breaking in that they do not contain equal amounts of enantiomers, though which is the dominant species depends on the substituent X.Herein, a 7.35 wt% Co loading C-SAC is synthesized by pyrolysis of Co-MOF-74 in a strongly polar molten salt system. In dye-sensitized solar cells, this SAC based counter electrode shows higher photoelectric conversion efficiency than the Pt counter electrode. This work provides new insights for the preparation and application of C-SACs.Today, it is extremely urgent to face the increasing shortage of clean and safe water resources, determined by the exponential growth of both world population and its consumerism, climate change and pollution. Water remediation from traditional chemicals and contaminants of emerging concerns (CECs) is supposed to be among the major methods to solve water scarcity issues. Reverse osmosis (RO) and nanofiltration (NF) membrane separation technologies have proven to be feasible, sustainable and highly effective methods for the removal of contaminants, comprising the extremely persistent and recalcitrant perfluoroalkyl substances (PFASs), which failed to be treated through the traditional water treatment approaches. So far, however, they have been unable to assure PFASs levels under the established guidance limits for drinking water and still suffer from fouling problems, which limit their large-scale application. Novel configurations, improvement in process design and the development of high-performant materials A series of novel non-gallate near-infrared long-persistent phosphorescence Mg2-xZnxSnO4Cr3+ phosphors were synthesized, and their structure and luminescence properties were investigated systematically. Under 448 nm blue light excitation, all the phosphors exhibit a broad emission band centered at 730 nm and a shoulder peak at 708 nm, which are attributed to the 4T2(4F) → 4A2 and 2E → 4A2 transitions of Cr3+, respectively. The excitation spectra of the samples clearly show the characteristic excitation of Cr3+ in the octahedral crystal field, with three obvious peaks at 324, 448 and 620 nm respectively. The phosphor with a composition of Mg1.4Zn0.6SnO40.03Cr3+ shows the strongest photoluminescence intensity which is 2.87 times and 3.09 times that of Mg2SnO40.03Cr3+ and Zn2SnO40.03Cr3+, respectively. Besides, all the samples show intense near-infrared long-persistent phosphorescence. For the optimized sample Mg1.4Zn0.6SnO40.005Cr3+, its phosphorescence can still be observed with a night vision instrument 18 h To ascertain the influence of binary ligand systems [1,1-dicyanoethylene-2,2-dithiolate (i-mnt-2) and polyamine tetraen = tris(2-aminoethyl)amine, tren = diethylene triamine and opda = o-phenylenediamine] on the coordination modes of the Ni(ii) metal center and resulting supramolecular architectures, a series of nickel(ii) thiolate complexes [Ni(tetraen)(i-mnt)](DMSO) (1), [Ni2(tren)2(i-mnt)2] (2), and [Ni2(i-mnt)2(opda)2]n (3) have been synthesized in high yield in one step in water and structurally characterized by single crystal X-ray crystallography and spectroscopic techniques. X-ray diffraction studies disclose the diverse i-mnt-2 coordination to the Ni+2 center in the presence of active polyamine ligands, forming a slightly distorted octahedral geometry (NiN4S2) in 1, square planar (NiS4) and distorted octahedral geometries (NiN6) in the bimetallic co-crystallized aggregate of cationic [Ni(tren)2]+2 and anionic [Ni(i-mnt)2]-2 in 2, and a one dimensional (1D) polymeric chain along the [100] axis in 3,In this work, an efficient and facile strategy has been adopted for the stepwise synthesis of the RGO-MSiO2/PdO hybrid nanomaterial (HY-NM). Herein, a hybrid nanostructure of mesoporous silica over graphene oxide (GO) sheets has been developed followed by immobilizing palladium oxide nanoparticles (PdO NPs), and then it has been utilized for catalyzing a multicomponent reaction (MCR). To authenticate the successful synthesis of the HY-NM and successive immobilization of PdO NPs, various physicochemical characterization techniques were utilized such as SEM, EDAX, HR-TEM, HR-XRD, TGA, BET, FT-IR, and XPS analysis. The activity of the HY-NM has been determined by performing the catalyst-mediated synthesis of β-substituted indole derivatives (yield 90-98%). The excellent catalytic activity of the prepared HY-NM could be observed due to its high surface area and large porosity, which facilitates the penetration and interaction of reactant molecules with the catalytic active species. This protocol eliminates the reThis computational study presents the molecular conduction properties of two members of the polyoxovanadate (POV) class of molecules, V6O19 (Lindqvist-type) and V18O42, which have been targeted as possible successors of the materials that are currently used in complementary metal-oxide semiconductor (CMOS) technology. Molecular conductivity calculations on the Lindqvist-type POV absorbed on Au(111) shows a staircase conductivity as function of the applied bias voltage, which is directly related to the oxidation state of the absorbed molecule. After these proof-of-principle calculations we applied the same technique to the larger V18O42, a system featuring many more easily attainable redox states, and hence, in principle even more interesting from the multiple-state resistive (memristive) viewpoint. The calculated transmission strongly suggests that this molecule does not possess staircase conductivity, a fact ascribed to the large number of unpaired electrons in the resting state.Lithium-sulfur batteries have a high theoretical energy density but they need better sulfur host materials to retain the lithium polysulfide shuttle effect, which results in the batteries’ capacity fading. Titanium carbide MXene (Ti3C2Tx MXene) is an excellent host for the sulfur cathode because of its layered-stacked structure and many surface termination groups. The sulfur content in S/Ti3C2Tx MXene composites is an important factor affecting the cathodes’ electrochemical performance. In this work, S/Ti3C2Tx MXene composites with different sulfur contents are prepared by a one-step hydrothermal process, and the influence of the sulfur content in the S/Ti3C2Tx MXene composite on the S/Ti3C2Tx MXene cathode’s electrochemical performance is studied. When the mass ratio of sulfur to MXene in the reactant is 4  1, the sulfur nanoparticles are uniformly filled in the layered-stacked structure. The layered-stacked structure can buffer the volume expansion of sulfur during cycling and the surface termination groupsOxygen electroreduction (ORR) via a two-electron pathway is a promising alternative for hydrogen peroxide (H2O2) synthesis in small-scale applications. In this work, nitrogen and sulfur co-doped carbon coated zinc sulfide nanoparticles (ZnS@C) are synthesized using facile high-temperature annealing. In an alkaline electrolyte, the presence of ZnS suppresses the reduction of H2O2 during the ORR and contributes to high H2O2 selectivity (∼90%) over a wide potential range (0.40-0.80 V). Continuous generation of H2O2 is in turn achieved at an outstanding rate of 1.485 mol gcat.-1 h-1 with a faradaic efficiency of 93.7%.In order to harvest more light wavelengths to improve the light-assisted electrochemical water splitting capacity, we developed a novel heterostructure of three-dimensional (3D) flower-like CuS architecture with accompanying SnS2 nanoparticles and reduced graphene oxide (rGO) aerogel for outstanding light-assisted electrocatalytic OER performance and good stability. The excellent catalytic kinetics, effective capturing of visible light, and rapid charge transfer of the CuS/SnS2/rGO (CSr) heterostructure were demonstrated. The overpotential (264 mV@10 mA cm-2) under light-assisted conditions is 20% lower than that under light-chopped conditions. SnS2 can harvest more light wavelengths and this boosts its intrinsic activity. However, with the increase of the SnS2 content, the OER activity decreases. The combination of the CS heterostructure and the rGO conductive aerogel achieves rapid charge transfer. Furthermore, the possible mechanism of the light-assisted electrocatalytic OER was also proposed. Overall, thiIn this report, we demonstrate a bimetallic Co/Cu-embedded N-doped carbon structure for trifunctional catalysis of oxygen reduction, oxygen evolution and hydrogen evolution reactions in alkaline media. A hybrid catalyst synthesized through a metal-organic framework-based process (M-NC-CoCu) enables an active trifunctional catalysis due to its multi-faceted favorable characteristics. It is believed that a range of catalytically active sites are formed through the approach including well-dispersed tiny CuCo2O4 phases, a high concentration of pyridinic and graphitic N, and Cu-Ox, Cu-Nx and Co-Nx moieties. In addition, a high-surface-area morphology with a high concentration of sp2 bonding, which is beneficial for facilitated electron conduction, further contributes to the performance as an electrocatalyst.Macroplastics are the primary contributor to riverine plastic pollution by mass, posing a wide range of serious threats for riverine systems, from adversely affecting various life forms within the riverine system, to potentially increasing flood risk, and generally resulting in adverse effects on any livelihoods. Compared to other river-related research disciplines, research into riverine macroplastics and their effects has not yet featured prominently. Various quantification methods are presently used to assess the presence of macroplastics at different locations within river systems; however, overcoming limitations and unifying methods remain an essential need. Macroplastic dynamics in rivers are subject to various factors, including both material and river characteristics. We review the diverse factors that potentially influence macroplastic dynamics in rivers, and highlight our knowledge limits. We advocate for future research that enables synergies between improved field quantification techniques, use ofTo compare the effects of three mannans, Konjac glucomannan (KGM), guar gum (GG) and locust bean gum (LBG), on obesity and obesity-related metabolic disorders in mice fed with high-fat diet (HFD), and to investigate the potential modulation of gut microbiota, we performed a 14 week study on C57BL/6J mice fed a HFD with/without mannan supplementation. The results showed that supplementing 8% KGM, GG, and LBG to a HFD dramatically reduced the body weight gain and adipose accumulation, attenuated liver injury, and antagonized glycolipid metabolism and inflammation-related parameters of HFD-fed mice in different degrees. However, only LBG had such roles when the supplement dose was reduced to 2%. In addition, it was found that LBG required more time to exert its impacts on weight control and lipid metabolism. Furthermore, 16S rRNA gene sequencing of gut microbiota indicated that mannans with different structures and supplement doses affected the overall structure of the gut microbiota to a varying extent and specThree half-sandwich organometallic ruthenium(ii) complexes containing purine analogs such as triazolopyrimidines of general formula [(η6-p-cym)Ru(L)Cl2], where p-cym represents p-cymene and L is 5,6,7-trimethyl-1,2,4-triazolo[1,5-a]pyrimidine (tmtp for 1), 5,7-diethyl-1,2,4-triazolo[1,5-a]pyrimidine (detp for 2) and 5-methyl-1,2,4-triazolo[1,5-a]pyrimidin-7(4H)-one (HmtpO for 3), have been synthesized and characterized by elemental analysis, infrared, multinuclear magnetic resonance spectroscopic techniques (1H, 13C, 15N), and single-crystal X-ray diffraction (for 1 and 2). All these complexes have been thoroughly screened for their in vitro cytotoxicity against MCF-7 and HeLa cell lines as well as L929 murine fibroblast cells, indicating [(η6-p-cym)Ru(HmtpO)Cl2] (3) as the most active representative against the HeLa cell line and simultaneously being 64-fold less toxic to normal L929 murine fibroblast cells than cisplatin. At the same time, 3 has shown antimetastatic activity comparable to NAMI-A against HeLThe ability of four mononuclear nonheme iron(iv)-oxo complexes supported by polydentate nitrogen donor ligands to degrade organic pollutants has been investigated. The water soluble iron(ii) complexes upon treatment with ceric ammonium nitrate (CAN) in aqueous solution are converted into the corresponding iron(iv)-oxo complexes. The hydrogen atom transfer (HAT) ability of iron(iv)-oxo species has been exploited for the oxidation of halogenated phenols and other toxic pollutants with weak X-H (X = C, O, S, etc.) bonds. The iron-oxo oxidants can oxidize chloro- and fluorophenols with moderate to high yields under stoichiometric as well as catalytic conditions. Furthermore, these oxidants perform selective oxidative degradation of several persistent organic pollutants (POPs) such as bisphenol A, nonylphenol, 2,4-D (2,4-dichlorophenoxyacetic acid) and gammaxene. This work demonstrates the utility of water soluble iron(iv)-oxo complexes as potential catalysts for the oxidative degradation of a wide range of toxic We developed a new coarse-grained (CG) molecular dynamics force field for polyacrylamide (PAM) polymer based on fitting to the quantum mechanics (QM) equation of state (EOS). In this method, all nonbond interactions between representative beads are parameterized using a series of QM-EOS, which significantly improves the accuracy in comparison to common CG methods derived from atomistic molecular dynamics. This CG force-field has both higher accuracy and improved computational efficiency with respect to the OPLS atomistic force field. The nonbond components of the EOS were obtained from cold-compression curves on PAM crystals with rigid chains, while the covalent terms that contribute to the EOS were obtained using relaxed chains. For describing PAM gels we developed water-PAM interaction parameters using the same method. We demonstrate that the new CG-PAM force field reproduces the EOS of PAM crystals, isolated PAM chains, and water-PAM systems, while successfully predicting such experimental quantities as deMetal-organic frameworks (MOFs) have emerged as a new class of ionic conductors because of their tuneable and highly ordered microporous structures. The ionic conduction of various ionic carriers, such as a proton (H+), hydroxide ion (OH-), lithium ion (Li+), sodium ion (Na+), and magnesium ion (Mg2+), in the pores of MOFs has been widely investigated over the past decade. Reports reveal that the porous or channel structures of MOFs are fundamentally suitable as ion-conducting pathways. There are clear differences in the basic designs of ion-conductive MOFs, i.e., the introduction of ionic carriers and construction of efficient ion-conducting pathways, depending on the ionic carriers. We summarize the examples and fundamental design of highly ion-conductive MOFs with various types of ionic carriers.Vanadium remains an important microalloying element in the metallurgical industry and has more recently become important in energy storage. Such applications provide important opportunities in carbon reduction initiatives. They must be exploited safely and therefore understanding the toxicological profile of vanadium and its compounds, and ensuring ongoing regulatory efforts are appropriate is vital. This perspective details some of the technical challenges and common misconceptions in vanadium chemistry and toxicology and outlines knowledge gaps and areas of research that the authors believe must be addressed to achieve full benefit within a scientifically sound regulatory framework.Functional metal-organic squares (MOSs) and metal-organic cubes (MOCs) are important building units for zeolite-like metal-organic frameworks (ZMOFs), which are required to exhibit solid-state properties, such as dielectric, conductive, and magnetic properties. This work describes the preparation and magnetism of a tetracopper(ii) macrocyclic complex [CuII4(im-H2bizn)4(DMSO)3(THF)](ClO4)4·8DMSO (1) (Him-H2bizn = 4,5-bis(4,5-dihydro-1H-imidazol-2-yl)imidazole) as a MOS and octametallic clusters [NiII8(im-H2bizn)12](ClO4)4·10MeOH·3H2O (2) and [MnII4MnIII4(im-H2bizn)12](ClO4)8·14MeOH (3) as MOCs. The CuII ion in 1 possesses a five-coordinated square pyramidal geometry, resulting in the formation of an M4L4-type square, which gives an estimated intramolecular antiferromagnetic interaction with an exchange coupling constant of JCu-Cu = -95 K. Meanwhile, 2 and 3 present six-coordinated octahedral geometries, giving M8L12-type cubes, of which 2 is a normal paramagnetic compound with intramolecular antiferromagnetic New effective antimicrobial agents with novel modes of action are urgently needed due to the continued emergence of drug-resistant bacteria. Here, three ruthenium complexes functionalized with benzothiophene [Ru(phen)2(BTPIP)](ClO4)2 (Ru(II)-1), [Ru(dmp)2(BTPIP)](ClO4)2 (Ru(II)-2) and [Ru(dmb)2(BTPIP)](ClO4)2 (Ru(II)-3) (dmb = 4,4′-dimethyl-2,2′-bipyridine, phen = 1,10-phenanthroline, dmp = 2,9-dimethyl-1,10-phenanthroline) have been synthesized and their antimicrobial activities in vitro were assessed. Minimum inhibitory concentration (MIC) assays indicated that the three Ru(II)-1, Ru(II)-2 and Ru(II)-3 complexes all showed antibacterial activity against Staphylococcus aureus and Pseudomonas aeruginosa. The most active Ru(II)-3 complex was further tested against biofilms. Furthermore, it was also tested whether complex Ru(II)-3 could serve as an antibacterial adjuvant. Interestingly, the checkerboard data showed that Ru(II)-3 selectively exhibited synergism with aminoglycoside antibiotics. More importantly, [This retracts the article DOI 10.1093/cdn/nzab071.].