Banat Gul , Mohannad Mahmoud Ali Al-Hmoud , Muhammad Salman Khan , Siti Maisarah Aziz , Ghlamallah Benabdellah , Ayed M. Binzowaimil
{"title":"Unveiling the optoelectronic and thermoelectric properties of YAgCh2 (Ch = Se, Te): First-principles study","authors":"Banat Gul , Mohannad Mahmoud Ali Al-Hmoud , Muhammad Salman Khan , Siti Maisarah Aziz , Ghlamallah Benabdellah , Ayed M. Binzowaimil","doi":"10.1016/j.inoche.2025.114684","DOIUrl":"10.1016/j.inoche.2025.114684","url":null,"abstract":"<div><div>Ternary chalcogenides’ unique structural and electronic properties have concentrated them as desirable materials<!--> <!-->for energy applications. In the present study, we used density functional theory (DFT) calculations to explore the optoelectronic and thermoelectric features of YAgSe<sub>2</sub> and YAgTe<sub>2</sub> materials. The cohesive energies for YAgSe<sub>2</sub> and YAgTe<sub>2</sub> were predicted to be −4.57 eV/atom and −4.76 eV/atom, respectively.. Both materials display no signs of dynamic instability, as indicated by the absence of imaginary modes, signifying that they are thermodynamically stable. Both materials show semiconducting properties, based on their electronic band structure, although YAgTe<sub>2</sub> has a narrower band gap than YAgSe<sub>2</sub>, which renders it more suited for infrared absorption. The visible and near-infrared regions have high absorption coefficients, suggesting they could be used as absorber layers in optoelectronic devices. Furthermore, the important thermoelectric parameters are determined for evaluating thermoelectric performance. With low lattice thermal conductivity and favorable ZT, both materials exhibit potential thermoelectric efficiency, especially at high temperatures. The addition of YAgSe<sub>2</sub> and YAgTe<sub>2</sub>′s optical and thermoelectric features makes them material choices for solar energy conversion and storage. The investigation highlights the potential of these materials for sustainable energy technologies and provides an extensive theoretical framework for comprehending their features. Our results suggest a direction for future experiments to explore and refine these chalcogenides for thermoelectric and solar applications.</div></div>","PeriodicalId":13609,"journal":{"name":"Inorganic Chemistry Communications","volume":"179 ","pages":"Article 114684"},"PeriodicalIF":4.4,"publicationDate":"2025-05-14","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"144069563","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Surya Nath Pandey , Muhammad Afzal , Ahsas Goyal , G. Padma Priya , Biswaranjan Mohanty , Kavita Goyal , Mohit Rana , Mohd Imran
{"title":"Quantum dot biosensors for Glioblastoma: Merging nanotechnology with precision oncology","authors":"Surya Nath Pandey , Muhammad Afzal , Ahsas Goyal , G. Padma Priya , Biswaranjan Mohanty , Kavita Goyal , Mohit Rana , Mohd Imran","doi":"10.1016/j.inoche.2025.114671","DOIUrl":"10.1016/j.inoche.2025.114671","url":null,"abstract":"<div><div>Glioblastoma (GBM) is the most lethal primary brain tumor, with median survival under 15 months, largely due to late-stage diagnosis and inadequate monitoring of therapy response. Conventional modalities such as MRI and histopathology lack the sensitivity and molecular specificity required for early detection and real-time assessment. Semiconductor quantum dot (QD) biosensor nanocrystals with size-tunable emission, high photostability, and multiplexing capacity offer an innovative solution. CdSe–CdS core–shell and carbon-based QDs, bioconjugated via EDC/NHS or thiol–maleimide chemistries to antibodies or aptamers against EGFRvIII, IDH1/2 mutations, and MGMT promoter methylation, transduce biomarker binding into quantitative optical signals through FRET or multiplexed immunoassays. Analysis of plasma and cerebrospinal fluid achieves simultaneous detection of nucleic acid and protein markers at sub-picomolar sensitivity, while real-time imaging of QD drug conjugates enables personalized therapy tracking. However, heavy metal toxicity, nanoparticle aggregation, and stringent regulatory requirements currently hinder clinical translation. Surface-modification strategies PEGylation, silica encapsulation, and zwitterionic ligand coatings are under development to enhance biocompatibility and in vivo stability. Optimizing QD composition and functionalization will be critical to realizing rapid, minimally invasive GBM diagnostics and dynamic treatment evaluation.</div></div>","PeriodicalId":13609,"journal":{"name":"Inorganic Chemistry Communications","volume":"179 ","pages":"Article 114671"},"PeriodicalIF":4.4,"publicationDate":"2025-05-14","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"144084409","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Sijia Song , Qianhao Qu , Hongmei Xie , Jie Zhang , Jia Zeng , Shuang Chen , Guilin Zhou
{"title":"High performance CoMn solid solution oxide catalyst prepared by simple co-precipitation method for toluene low temperature oxidation removal from air","authors":"Sijia Song , Qianhao Qu , Hongmei Xie , Jie Zhang , Jia Zeng , Shuang Chen , Guilin Zhou","doi":"10.1016/j.inoche.2025.114678","DOIUrl":"10.1016/j.inoche.2025.114678","url":null,"abstract":"<div><div>In this paper, the Co<sub>x</sub>Mn composite oxide catalysts with Co-O-Mn solid solution structure were prepared by a simple precipitation method. The characterization techniques, such as XRD, Raman, TEM, XPS, H<sub>2</sub>-TPR and O<sub>2</sub>-TPD, were employed for analyzing the physicochemical properties of the prepared catalysts, and the catalytic activity was evaluated by the toluene oxidation performance in air. Compared with the CoMn<sub>2</sub>O<sub>4</sub> spinel composite oxide catalyst prepared by solvothermal method, the precipitation method can improve the Co species to dissolve into the MnO<sub>2</sub> lattice to form a Co-O-Mn solid solution. The interaction between Co and Mn oxides effectively weakened the metal–oxygen bonds. The results promoted the oxygen vacancies and active oxygen species to be formed on the surface of the corresponding catalysts, increased the oxygen movement in the Co<sub>x</sub>Mn composite oxide catalysts, and improved the catalytic oxidation performance of the corresponding catalysts. The Co<sub>1</sub>Mn catalyst with a Co content of 1.0 % could achieve a toluene oxidation removal rate over 97.0 % at a reaction temperature of 150 °C. At the same time, the Co<sub>1</sub>Mn catalyst has good stability and water resistance for toluene catalytic oxidation in air.</div></div>","PeriodicalId":13609,"journal":{"name":"Inorganic Chemistry Communications","volume":"179 ","pages":"Article 114678"},"PeriodicalIF":4.4,"publicationDate":"2025-05-14","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"144106627","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
N.A. Awang , W.N. Wan Salleh , S.Z.N. Ahmad , N.A. Mohd Razali , N. Sazali , A.F. Ismail
{"title":"Synergistic effect of molar ratio on lead removal by Zn-Al layered double hydroxide","authors":"N.A. Awang , W.N. Wan Salleh , S.Z.N. Ahmad , N.A. Mohd Razali , N. Sazali , A.F. Ismail","doi":"10.1016/j.inoche.2025.114660","DOIUrl":"10.1016/j.inoche.2025.114660","url":null,"abstract":"<div><div>This study investigates the removal of Pb(II) ions from aqueous solutions using Zinc Aluminum Layered Double Hydroxide (Zn/Al LDH) synthesized at different Zn molar ratios (1:1, 1:2, 2:1, 1:3, and 3:1). The adsorption efficiency of Zn/Al LDH was evaluated through batch adsorption experiments, and the effects of varying the molar ratios on adsorption capacity were examined. Characterization techniques including X-ray diffraction (XRD), Brunauer-Emmett-Teller (BET), field emission scanning electron microscopy (FESEM), energy dispersive X-ray analysis (EDX), Fourier-transform infrared (FTIR) as well as thermogravimetric analysis (TGA-DTG) were employed to analyze the structural and morphological properties of the synthesized materials. The Langmuir, Freundlich and Temkin isotherm models were applied to describe the adsorption process, revealing that the adsorption is best described by the Langmuir isotherm, indicating monolayer adsorption. The results demonstrated that the LDH with a 1:2 M ratio exhibited the highest adsorption capacity with 275.28 mg/g, attributed to its greater specific surface area and optimal distribution of active sites. The adsorption of Pb(II) ions onto Zn/Al LDH likely involves multiple mechanisms, such as surface adsorption, ion exchange, and chemical interactions. This study highlights the potential of Zn/Al LDH as an effective adsorbent for the removal of heavy metals from wastewater, with the molar ratio of Zn to Al playing a crucial role in determining the adsorption efficiency.</div></div>","PeriodicalId":13609,"journal":{"name":"Inorganic Chemistry Communications","volume":"179 ","pages":"Article 114660"},"PeriodicalIF":4.4,"publicationDate":"2025-05-13","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"144072034","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
M. Dahmani , A. Titi , S. Kadri , A. ET-Touhami , A. Yahyi , B. Tüzün , A. Zarrouk , R. Touzani , R.T. Boeré , F.A. Al-Misned , I. Warad
{"title":"Synthesis of two new Sn (IV) carboxylate complexes: Crystal structures, density functional theory and Hirshfeld surface analysis computation, antibacterial, antifungal, and bioinformatics potential determination","authors":"M. Dahmani , A. Titi , S. Kadri , A. ET-Touhami , A. Yahyi , B. Tüzün , A. Zarrouk , R. Touzani , R.T. Boeré , F.A. Al-Misned , I. Warad","doi":"10.1016/j.inoche.2025.114683","DOIUrl":"10.1016/j.inoche.2025.114683","url":null,"abstract":"<div><div>The current study presents two novel organotin (IV) carboxylate complexes, namely <strong>C1</strong> [NNNH-SnPh<sub>3</sub>]) and <strong>C2</strong> ([SCCO-SnBu<sub>2</sub>]<sub>4</sub>). <strong>C1</strong> and <strong>C2</strong> have been produced utilizing <strong>L1</strong> [4-(((3,5-dimethyl-1H-pyrazol-1-yl) methyl) amino) benzoic acid] and <strong>L2</strong> [(E)-3-(thiophen-2-yl) acrylic acid] as pro-ligands with carboxylic acid functionalities. The desired complexes were characterized via NMR and FT-IR spectroscopy and single crystal X-ray diffraction for the 3D structure. The ligands and their complexes were analyzed for their structural properties using HF, B3LYP and M062X/6-31 + G(d,p) computational methods. Moreover, to support the crystallographic results, complex <strong>C1</strong> was subjected to Hirshfeld surface analysis. Furthermore, the antibacterial and antifungal properties of both <strong>C1</strong> and <strong>C2</strong>, as well as free <strong>L1</strong> and <strong>L2</strong>, were examined. We have examined and enhanced several characteristics, such as physicochemical qualities, toxicity hazards, and optimal structures, using bioinformatics calculations. Subsequently, the molecular interactions with target proteins, specifically the structure of Pseudomonas aeruginosa (PDB ID: 2UV0) and the structure of Escherichia coli (PDB ID: 4PRV), were analyzed to explain their experimental activities.</div></div>","PeriodicalId":13609,"journal":{"name":"Inorganic Chemistry Communications","volume":"179 ","pages":"Article 114683"},"PeriodicalIF":4.4,"publicationDate":"2025-05-13","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"144072032","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
{"title":"Interfacial mechanisms of uranium removal using bismuth hydroxide-impregnated graphitic carbon nitride","authors":"Lakshmi Prasanna Lingamdinne , Maheswara Reddy Lebaka , Nadavala Siva Kumar , Mohammad Asif , Gajanan Sampatrao Ghodake , Janardhan Reddy Koduru","doi":"10.1016/j.inoche.2025.114666","DOIUrl":"10.1016/j.inoche.2025.114666","url":null,"abstract":"<div><div>The effective extraction and recovery of U(VI) from wastewater through a straightforward adsorption approach is essential for mitigating environmental hazards and enabling the recycling of nuclear materials. In this study, a bismuth hydroxide (Bi(OH)<sub>3</sub>)-doped graphitic carbon nitride (GCN) composite was synthesized and tested for U(VI) adsorption. The GCN/Bi(OH)<sub>3</sub> composite was thoroughly characterized using advanced spectroscopy and microscopy techniques including XRD, FTIR, SEM, EDS, and XPS. The influence factors such as pH, initial concentration, contact time, and thermodynamic properties on the adsorption process was thoroughly examined. The maximum U(VI) up taking capacity of GCN/Bi(OH)<sub>3</sub> reached 118.56 mg/g at a pH of 4.0 and a temperature of 293 K. This significant enhancement in adsorption capacity demonstrates the effectiveness of Bi(OH)<sub>3</sub> doping in improving the material’s ability to capture U(VI) ions. The GCN/Bi(OH)<sub>3</sub> composite also exhibited a stable spherical structure, excellent regeneration potential, and reusability, making it an ideal candidate for sustainable use. The primary mechanism driving U(VI) adsorption was found to be inner surface complexation through endothermic, as confirmed by experimental and characterization analyses. This study introduces a simple and effective synthesis method for producing GCN/Bi(OH)<sub>3</sub>, a promising adsorbent for the efficient removal and recovery of U(VI) from radioactive wastewater and re-used more than six cycles with 70% removal efficiency, contributing to environmental protection and resource recovery.</div></div>","PeriodicalId":13609,"journal":{"name":"Inorganic Chemistry Communications","volume":"179 ","pages":"Article 114666"},"PeriodicalIF":4.4,"publicationDate":"2025-05-13","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"144072033","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
{"title":"Performance assessment of hydrothermal fabrication of nitrogen-rich activated bio-carbon from different constituent’s agro-wastes for cationic and anionic dyes removal","authors":"Altaf H. Basta, Vivian F. Lotfy","doi":"10.1016/j.inoche.2025.114672","DOIUrl":"10.1016/j.inoche.2025.114672","url":null,"abstract":"<div><div>Nowadays, organic dye pollution poses a number of serious hazards to human health and aquatic ecosystems. Moreover, the literature reported that the efficiency of removing the anionic dyes by adsorbent is quite low, and it needs chemical modification to introduce functional groups able This problem can be tackled by the chemical modification of straw to improve its sorption capacity via introducing functional groups able to adsorbed –ve dyes, e.g., amino groups. These problems persuade the growing demand for carbon nanostructures, as low effective cost adsorbents which possess acceptable adsorbent properties and are environmentally friendly, for achieving this objective. The assessment was carried out on using different constituent’s agro-precursors activated by Lab synthesized alkaline potassium ferrate-assisted (K<sub>2</sub>FeO<sub>4</sub>; KF)/ potassium hydroxide (KOH; K), then introducing N-atom through hydrothermal route (N-doped porous bio-carbons). The carbon precursors used were giant reed (GR), date palm fiber (DP), and sugar-cane bagasse (SCB). The investigated adsorbents were characterized by different techniques; while their adsorption behavior was estimated from the removal efficiency of anionic dye [reactive black 5 dye (RB5) together with cationic dye [methylene blue (MB)]. The data showed that the N-doped activated bio-carbon (SCB-KF) had the greatest BET surface area and total pore volume, measuring 503.5 m<sup>2</sup>/g and 0.403 cm<sup>3</sup>/g, respectively. As can be seen, the inclusion of nitrogen in porous ACs led to the reduction of the microporosity character, as emphasized from creation of larger holes on the surface (SEM micrograph). The obtained data emphasized the success of N-doping in production appropriate adsorbent of MB (182.1 mg/g), and exhibited superior performance for anionic RB5 dye adsorption (∼120 mg/g), albeit the literature demonstrating poorer performance. Freundlich isotherms and pseudo-second order kinetic models are the best models that describe the MB adsorption on the surface of the N-doped ACs under investigation. Through hydrogen bonding, π-π interaction, electrostatic interaction, and pore diffusion, the adsorption mechanism proceeds.</div></div>","PeriodicalId":13609,"journal":{"name":"Inorganic Chemistry Communications","volume":"179 ","pages":"Article 114672"},"PeriodicalIF":4.4,"publicationDate":"2025-05-12","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"143948406","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
V. Swathi Pon Sakthi Sri , Raj Kiran Lakra , V. Harini , Dilip Kumar Jha , T.S. Kumar , P. Arokia Arthi , D. Magesh Peter , G. Dharani
{"title":"Hydroxyapatite extraction from buoy-retrieved marine oyster shells in the Arabian sea","authors":"V. Swathi Pon Sakthi Sri , Raj Kiran Lakra , V. Harini , Dilip Kumar Jha , T.S. Kumar , P. Arokia Arthi , D. Magesh Peter , G. Dharani","doi":"10.1016/j.inoche.2025.114667","DOIUrl":"10.1016/j.inoche.2025.114667","url":null,"abstract":"<div><div>The current work discloses the use of marine oyster shells obtained from the retrieved data buoy in the Arabian sea for cost-effective hydroxyapatite (HAp) extraction, its antioxidant and cytotoxic properties. Oyster shell derived HAp exhibited characteristics fourier transform infra-red (FTIR) peaks denoting the functional groups such as hydroxyl, carbonate, and phosphate. FT-Raman analysis proved the existence of carbonate and phosphate moieties at 1083 cm<sup>−1</sup>, 1045 cm<sup>−1</sup>, 962 cm<sup>−1</sup>, 587 cm<sup>−1</sup>, and 431 cm<sup>−1</sup>. From X-ray diffraction (XRD) studies, the extracted HAp is crystalline in nature. Dynamic light scattering (DLS) particle size analysis revealed the size of the particles to be 132.7 nm in aqueous dispersion. Scanning electron microscopic (SEM) analysis confirmed the slightly agglomerated spherical particles. Further, from high resolution transmission electron microscopic (HRTEM) images it was envisioned that the particles were spherical with size ranging from 150 to 350 nm with an average particle size 226.15 nm. To assess the free radical scavenging ability, 2,2-diphenyl-1-picrylhydrazyl (DPPH) assay was performed which confirmed that at increasing concentrations, the scavenging rate was higher. In addition, cytotoxic studies against A549 human lung cancer cells exhibited a half-maximal inhibitory concentration (IC<sub>50</sub>) value of 296.5 ± 2.52 µg/mL. The results ascertain that oyster shell derived HAp unveiled dose dependent antioxidant and cytotoxic potentials. Forthcoming years, HAp related novel product formulations may be prolific for health and pharmacological industries.</div></div>","PeriodicalId":13609,"journal":{"name":"Inorganic Chemistry Communications","volume":"179 ","pages":"Article 114667"},"PeriodicalIF":4.4,"publicationDate":"2025-05-12","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"144069580","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Xinbo Yu , Shuyuan Hu , Yonghui Zhou , Zhaocun Yu , Hanjiao He , Song Lin , Yi Long
{"title":"Green synthesis of electrospun composite material loaded with ultrasmall Ag nanoparticles","authors":"Xinbo Yu , Shuyuan Hu , Yonghui Zhou , Zhaocun Yu , Hanjiao He , Song Lin , Yi Long","doi":"10.1016/j.inoche.2025.114681","DOIUrl":"10.1016/j.inoche.2025.114681","url":null,"abstract":"<div><div>Ag nanoparticles (AgNPs) are recognized for their excellent antibacterial properties and low toxicity, making them ideal for biomedical applications. Combining AgNPs with electrospun polyethersulfone (PES) has significant potential owing to the structural advantages of electrospun fibers and the antimicrobial efficiency of AgNPs. The biological activity of metal nanoparticles is often closely related to their size, with smaller particles generally exhibiting higher efficacy. However, existing synthesis methods tend to produce larger AgNPs, which limits their potential. In this study, electrospun PES was used as a support matrix to prepare an Ag nanoparticle (NP)-PES electrospun composite in which the majority of AgNPs measured under 60 mm in diameter. Bacteriostatic experiments revealed that this AgNP-PES electrospun composite possessed effective antibacterial activity against both <em>Escherichia coli</em> (gram-negative bacteria) and <em>Staphylococcus aureus</em> (gram-positive bacteria). The enhanced antibacterial activity was attributed to the small size of the AgNPs. Moreover, cytotoxicity tests confirmed that the electrospun composite was non-toxic to cells. Animal experiments showed that the AgNP-PES electrospun composite significantly promoted wound healing, particularly in burn wounds infected with <em>S. aureus</em>. More importantly, the preparation process was environmentally friendly, relying solely on sunlight as the energy source. Thus, the AgNP-PES electrospun composite shows significant potential for medical applications.</div></div>","PeriodicalId":13609,"journal":{"name":"Inorganic Chemistry Communications","volume":"179 ","pages":"Article 114681"},"PeriodicalIF":4.4,"publicationDate":"2025-05-11","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"144069528","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Palani Purushothaman, K.R. Abesake, V. Santhosh, Subramanian Karpagam
{"title":"Fc-DNP/PVDF nanofiber matrix for selective visual detection of cyanide ion (CN−) from tobacco, food, and water samples via a ratiometric process","authors":"Palani Purushothaman, K.R. Abesake, V. Santhosh, Subramanian Karpagam","doi":"10.1016/j.inoche.2025.114645","DOIUrl":"10.1016/j.inoche.2025.114645","url":null,"abstract":"<div><div>A highly selective detection of cyanide ion (CN<sup>−</sup>) in multiple way has been achieved by Fc-DNP, an azomethine functionalized ferrocene clutched compound. The synthesized probe has been systematically characterized and the final confirmation was obtained through SC-XRD. Fc-DNP crystallises in a monoclinic crystal system with a P-1, 21/C1 centrosymmetric space group. The probe has shown excellent photophysical properties, and aggregation induced emission (AIE) property makes it an appropriate material for real-time application. The synthethised probe Fc-DNP has been incorporated with PVDF matrix via electrospinning technique to obtain Fc-DNP/PVDF nano fibre matrix. Henceforth, Fc-BPy has been deployed for the selective detection of CN<sup>−</sup> in multiple methods, including naked eye colorimetric, fluorimetric and solid-state detection. The probe demonstrates a substantial color change upon introduction of CN<sup>−</sup> from pale yellow to wine with significant shift in absorbance of the Fc-DNP probe from 393 nm to 501 nm distincitve indication of ratiometric detection of cyanide ion. The detection efficacy of the probe were also in solid state matrix, which exhibited commendable limit of detection (LOD) 4.90 × 10<sup>−10</sup> M. The detection mechanism and stoichiometric ratio were validated through NMR titration, Jobs plot and DFT studies. Furthermore, the practical applicatbility of the probe Fc-DNP was evaluated from commercial tobacco sample, food and water samples. The recovery rate was quite astounding with the relative standard deviation (RSD) ≤1.15 %, ≤1.21 % and ≤1.33 % based on triplicate measurements. Thus, Fc-DNP emerges as a cost-effective, simple probe for CN<sup>−</sup> detection across different analytical techniques.</div></div>","PeriodicalId":13609,"journal":{"name":"Inorganic Chemistry Communications","volume":"179 ","pages":"Article 114645"},"PeriodicalIF":4.4,"publicationDate":"2025-05-11","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"144069581","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}