{"title":"纳米二氧化硅催化咪唑衍生物的合成、核磁共振波谱和光物理研究","authors":"T. S. Rajasekar, N. Srinivasan, K. Jayamoorthy","doi":"10.1007/s12633-024-03176-5","DOIUrl":null,"url":null,"abstract":"<div><p>This study explores the use of nano SiO<sub>2</sub> as a catalyst in the synthesis of imidazole derivatives, demonstrating its superior catalytic efficiency compared to conventional catalysts. The high surface area of nano SiO<sub>2</sub> significantly enhances reactant interactions, resulting in higher yields of imidazole products. Detailed NMR spectral analysis provided precise characterizations of the imidazole derivatives, revealing well-defined chemical shifts. The influence of solvent polarity on absorption and fluorescence spectra was investigated, showing that polar solvents induce pronounced bathochromic shifts by stabilizing the excited states through hydrogen bonding and dipole interactions. Quantum yield and emission kinetics analyses highlighted the role of non-radiative decay pathways in reducing fluorescence efficiency. Furthermore, DFT calculations of HOMO–LUMO energies elucidated how substituents affect electronic transitions and solvatochromic shifts. These findings underscore the effectiveness of nano SiO<sub>2</sub> as a catalyst, illustrate the impact of solvent interactions on molecular behavior, and provide comprehensive insights into the electronic properties of imidazole derivatives, offering valuable implications for both research and practical applications.</p></div>","PeriodicalId":776,"journal":{"name":"Silicon","volume":"16 18","pages":"6555 - 6565"},"PeriodicalIF":2.8000,"publicationDate":"2024-10-15","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"0","resultStr":"{\"title\":\"Nano Silica Catalyzed Synthesis, NMR Spectral and Photophysical Studies of Imidazole Derivatives\",\"authors\":\"T. S. Rajasekar, N. Srinivasan, K. Jayamoorthy\",\"doi\":\"10.1007/s12633-024-03176-5\",\"DOIUrl\":null,\"url\":null,\"abstract\":\"<div><p>This study explores the use of nano SiO<sub>2</sub> as a catalyst in the synthesis of imidazole derivatives, demonstrating its superior catalytic efficiency compared to conventional catalysts. The high surface area of nano SiO<sub>2</sub> significantly enhances reactant interactions, resulting in higher yields of imidazole products. Detailed NMR spectral analysis provided precise characterizations of the imidazole derivatives, revealing well-defined chemical shifts. The influence of solvent polarity on absorption and fluorescence spectra was investigated, showing that polar solvents induce pronounced bathochromic shifts by stabilizing the excited states through hydrogen bonding and dipole interactions. Quantum yield and emission kinetics analyses highlighted the role of non-radiative decay pathways in reducing fluorescence efficiency. Furthermore, DFT calculations of HOMO–LUMO energies elucidated how substituents affect electronic transitions and solvatochromic shifts. These findings underscore the effectiveness of nano SiO<sub>2</sub> as a catalyst, illustrate the impact of solvent interactions on molecular behavior, and provide comprehensive insights into the electronic properties of imidazole derivatives, offering valuable implications for both research and practical applications.</p></div>\",\"PeriodicalId\":776,\"journal\":{\"name\":\"Silicon\",\"volume\":\"16 18\",\"pages\":\"6555 - 6565\"},\"PeriodicalIF\":2.8000,\"publicationDate\":\"2024-10-15\",\"publicationTypes\":\"Journal Article\",\"fieldsOfStudy\":null,\"isOpenAccess\":false,\"openAccessPdf\":\"\",\"citationCount\":\"0\",\"resultStr\":null,\"platform\":\"Semanticscholar\",\"paperid\":null,\"PeriodicalName\":\"Silicon\",\"FirstCategoryId\":\"88\",\"ListUrlMain\":\"https://link.springer.com/article/10.1007/s12633-024-03176-5\",\"RegionNum\":3,\"RegionCategory\":\"材料科学\",\"ArticlePicture\":[],\"TitleCN\":null,\"AbstractTextCN\":null,\"PMCID\":null,\"EPubDate\":\"\",\"PubModel\":\"\",\"JCR\":\"Q3\",\"JCRName\":\"CHEMISTRY, PHYSICAL\",\"Score\":null,\"Total\":0}","platform":"Semanticscholar","paperid":null,"PeriodicalName":"Silicon","FirstCategoryId":"88","ListUrlMain":"https://link.springer.com/article/10.1007/s12633-024-03176-5","RegionNum":3,"RegionCategory":"材料科学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"Q3","JCRName":"CHEMISTRY, PHYSICAL","Score":null,"Total":0}
Nano Silica Catalyzed Synthesis, NMR Spectral and Photophysical Studies of Imidazole Derivatives
This study explores the use of nano SiO2 as a catalyst in the synthesis of imidazole derivatives, demonstrating its superior catalytic efficiency compared to conventional catalysts. The high surface area of nano SiO2 significantly enhances reactant interactions, resulting in higher yields of imidazole products. Detailed NMR spectral analysis provided precise characterizations of the imidazole derivatives, revealing well-defined chemical shifts. The influence of solvent polarity on absorption and fluorescence spectra was investigated, showing that polar solvents induce pronounced bathochromic shifts by stabilizing the excited states through hydrogen bonding and dipole interactions. Quantum yield and emission kinetics analyses highlighted the role of non-radiative decay pathways in reducing fluorescence efficiency. Furthermore, DFT calculations of HOMO–LUMO energies elucidated how substituents affect electronic transitions and solvatochromic shifts. These findings underscore the effectiveness of nano SiO2 as a catalyst, illustrate the impact of solvent interactions on molecular behavior, and provide comprehensive insights into the electronic properties of imidazole derivatives, offering valuable implications for both research and practical applications.
期刊介绍:
The journal Silicon is intended to serve all those involved in studying the role of silicon as an enabling element in materials science. There are no restrictions on disciplinary boundaries provided the focus is on silicon-based materials or adds significantly to the understanding of such materials. Accordingly, such contributions are welcome in the areas of inorganic and organic chemistry, physics, biology, engineering, nanoscience, environmental science, electronics and optoelectronics, and modeling and theory. Relevant silicon-based materials include, but are not limited to, semiconductors, polymers, composites, ceramics, glasses, coatings, resins, composites, small molecules, and thin films.