{"title":"新型有机-无机氯化物(2-氨基-4-甲基吡啶六氯斯坦酸):晶体结构、BFDH形态和导电机理","authors":"Iheb Garoui , Sondes Hajlaoui , Mohamed Tliha , Raja Naouari , Saber Nasri , Ali Ouasri , Jérôme Lhoste , Abderrazek Oueslati","doi":"10.1016/j.jpcs.2025.112840","DOIUrl":null,"url":null,"abstract":"<div><div>Zero-dimensional (0D) organic–inorganic metal halides have garnered widespread attention for their exceptional chemical tunability and promising potential in optoelectronic applications. In this work, a novel (0D) organic-inorganic hybrid compound, named bis-2-amino-4- methylpyridinium hexa-chlorostannate (denoted (2A4P)<sub>2</sub>SnCl<sub>6</sub>), was successfully synthesized via the slow evaporation method at room temperature. X-ray diffraction analysis of both single crystals and powder samples revealed a pure monoclinic structure with a P2<sub>1</sub>/c space group. The Hirshfeld surfaces analysis indicates that H⋯Cl/Cl⋯H intercontact contributed significantly (68.2 %) to the (2A4P)<sub>2</sub>SnCl<sub>6</sub> crystal packing. The crystal morphology is predicted from Laue (2/m) and space group (P2<sub>1</sub>/c) symmetries of (2A4P)<sub>2</sub>SnCl<sub>6</sub>), which showed the screw axis (2<sub>1</sub>) effect on the Importance morphology facets. The thermal stability was evaluated through DSC heating analysis, and TG measurements showed that the compound remains stable up to 470 K. In contrast, the electrical properties were investigated using complex impedance spectroscopy (CIS), revealing significant dependence on both frequency and temperature, indicating the presence of a relaxation phenomenon and semiconductor-like behavior. The activation energy for the studied compound is determined using Arrhenius's formula based on DC conductivity, which found to be 0.69 eV. The alternating current conductivity (<span><math><mrow><msub><mi>σ</mi><mtext>ac</mtext></msub></mrow></math></span>) follows Jonscher's power law. Fitting the <span><math><mrow><msub><mi>σ</mi><mtext>ac</mtext></msub></mrow></math></span> curves indicates that the dominant transport mechanism is the correlated barrier hopping CBH model. Overall, the research sheds light on the synthesis, crystal arrangement, and analysis of charge transfer mechanisms in this novel semiconductor, emphasizing its electronic potential.</div></div>","PeriodicalId":16811,"journal":{"name":"Journal of Physics and Chemistry of Solids","volume":"206 ","pages":"Article 112840"},"PeriodicalIF":4.3000,"publicationDate":"2025-05-08","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"0","resultStr":"{\"title\":\"New Organic–Inorganic chloride (2-amino-4-methylpyridinium Hexachlorostannate): Crystal structure, BFDH morphology, and electrical conduction mechanism\",\"authors\":\"Iheb Garoui , Sondes Hajlaoui , Mohamed Tliha , Raja Naouari , Saber Nasri , Ali Ouasri , Jérôme Lhoste , Abderrazek Oueslati\",\"doi\":\"10.1016/j.jpcs.2025.112840\",\"DOIUrl\":null,\"url\":null,\"abstract\":\"<div><div>Zero-dimensional (0D) organic–inorganic metal halides have garnered widespread attention for their exceptional chemical tunability and promising potential in optoelectronic applications. In this work, a novel (0D) organic-inorganic hybrid compound, named bis-2-amino-4- methylpyridinium hexa-chlorostannate (denoted (2A4P)<sub>2</sub>SnCl<sub>6</sub>), was successfully synthesized via the slow evaporation method at room temperature. X-ray diffraction analysis of both single crystals and powder samples revealed a pure monoclinic structure with a P2<sub>1</sub>/c space group. The Hirshfeld surfaces analysis indicates that H⋯Cl/Cl⋯H intercontact contributed significantly (68.2 %) to the (2A4P)<sub>2</sub>SnCl<sub>6</sub> crystal packing. The crystal morphology is predicted from Laue (2/m) and space group (P2<sub>1</sub>/c) symmetries of (2A4P)<sub>2</sub>SnCl<sub>6</sub>), which showed the screw axis (2<sub>1</sub>) effect on the Importance morphology facets. The thermal stability was evaluated through DSC heating analysis, and TG measurements showed that the compound remains stable up to 470 K. In contrast, the electrical properties were investigated using complex impedance spectroscopy (CIS), revealing significant dependence on both frequency and temperature, indicating the presence of a relaxation phenomenon and semiconductor-like behavior. The activation energy for the studied compound is determined using Arrhenius's formula based on DC conductivity, which found to be 0.69 eV. The alternating current conductivity (<span><math><mrow><msub><mi>σ</mi><mtext>ac</mtext></msub></mrow></math></span>) follows Jonscher's power law. Fitting the <span><math><mrow><msub><mi>σ</mi><mtext>ac</mtext></msub></mrow></math></span> curves indicates that the dominant transport mechanism is the correlated barrier hopping CBH model. Overall, the research sheds light on the synthesis, crystal arrangement, and analysis of charge transfer mechanisms in this novel semiconductor, emphasizing its electronic potential.</div></div>\",\"PeriodicalId\":16811,\"journal\":{\"name\":\"Journal of Physics and Chemistry of Solids\",\"volume\":\"206 \",\"pages\":\"Article 112840\"},\"PeriodicalIF\":4.3000,\"publicationDate\":\"2025-05-08\",\"publicationTypes\":\"Journal Article\",\"fieldsOfStudy\":null,\"isOpenAccess\":false,\"openAccessPdf\":\"\",\"citationCount\":\"0\",\"resultStr\":null,\"platform\":\"Semanticscholar\",\"paperid\":null,\"PeriodicalName\":\"Journal of Physics and Chemistry of Solids\",\"FirstCategoryId\":\"88\",\"ListUrlMain\":\"https://www.sciencedirect.com/science/article/pii/S0022369725002926\",\"RegionNum\":3,\"RegionCategory\":\"材料科学\",\"ArticlePicture\":[],\"TitleCN\":null,\"AbstractTextCN\":null,\"PMCID\":null,\"EPubDate\":\"\",\"PubModel\":\"\",\"JCR\":\"Q2\",\"JCRName\":\"CHEMISTRY, MULTIDISCIPLINARY\",\"Score\":null,\"Total\":0}","platform":"Semanticscholar","paperid":null,"PeriodicalName":"Journal of Physics and Chemistry of Solids","FirstCategoryId":"88","ListUrlMain":"https://www.sciencedirect.com/science/article/pii/S0022369725002926","RegionNum":3,"RegionCategory":"材料科学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"Q2","JCRName":"CHEMISTRY, MULTIDISCIPLINARY","Score":null,"Total":0}
New Organic–Inorganic chloride (2-amino-4-methylpyridinium Hexachlorostannate): Crystal structure, BFDH morphology, and electrical conduction mechanism
Zero-dimensional (0D) organic–inorganic metal halides have garnered widespread attention for their exceptional chemical tunability and promising potential in optoelectronic applications. In this work, a novel (0D) organic-inorganic hybrid compound, named bis-2-amino-4- methylpyridinium hexa-chlorostannate (denoted (2A4P)2SnCl6), was successfully synthesized via the slow evaporation method at room temperature. X-ray diffraction analysis of both single crystals and powder samples revealed a pure monoclinic structure with a P21/c space group. The Hirshfeld surfaces analysis indicates that H⋯Cl/Cl⋯H intercontact contributed significantly (68.2 %) to the (2A4P)2SnCl6 crystal packing. The crystal morphology is predicted from Laue (2/m) and space group (P21/c) symmetries of (2A4P)2SnCl6), which showed the screw axis (21) effect on the Importance morphology facets. The thermal stability was evaluated through DSC heating analysis, and TG measurements showed that the compound remains stable up to 470 K. In contrast, the electrical properties were investigated using complex impedance spectroscopy (CIS), revealing significant dependence on both frequency and temperature, indicating the presence of a relaxation phenomenon and semiconductor-like behavior. The activation energy for the studied compound is determined using Arrhenius's formula based on DC conductivity, which found to be 0.69 eV. The alternating current conductivity () follows Jonscher's power law. Fitting the curves indicates that the dominant transport mechanism is the correlated barrier hopping CBH model. Overall, the research sheds light on the synthesis, crystal arrangement, and analysis of charge transfer mechanisms in this novel semiconductor, emphasizing its electronic potential.
期刊介绍:
The Journal of Physics and Chemistry of Solids is a well-established international medium for publication of archival research in condensed matter and materials sciences. Areas of interest broadly include experimental and theoretical research on electronic, magnetic, spectroscopic and structural properties as well as the statistical mechanics and thermodynamics of materials. The focus is on gaining physical and chemical insight into the properties and potential applications of condensed matter systems.
Within the broad scope of the journal, beyond regular contributions, the editors have identified submissions in the following areas of physics and chemistry of solids to be of special current interest to the journal:
Low-dimensional systems
Exotic states of quantum electron matter including topological phases
Energy conversion and storage
Interfaces, nanoparticles and catalysts.