Academic Journal
Acceleration of the Diels-Alder Reaction between 9-functionalized anthracenes and C60/C70 in the cavity of a water soluble subphthalocyanine cage
| العنوان: | Acceleration of the Diels-Alder Reaction between 9-functionalized anthracenes and C60/C70 in the cavity of a water soluble subphthalocyanine cage |
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| المؤلفون: | Salazar, Ainhoa, Labella Santodomingo, Jorge, Kumar, Sunit, Torres Cebada, Tomás, Torre Ponce, Gema de la |
| المساهمون: | UAM. Departamento de Química Orgánica |
| بيانات النشر: | Wiley |
| سنة النشر: | 2024 |
| المجموعة: | Universidad Autónoma de Madrid (UAM): Biblos-e Archivo |
| مصطلحات موضوعية: | Catalysis, Fullerene, Metallo-Organic Cage, Subphthalocyanine, Water, Química |
| الوصف: | The dataset that supports the findings of this study are archived in the Universidad Autónoma de Madrid data repository e‐cienciaDatos in https://doi.org/10.21950/9MBDR9 ; Herein we report on the acceleration of the Diels-Alder reaction between a series of 9-functionalized anthracenes and C60/C70 encapsulated in a water-soluble metallo-organic Pd(II)-subphthalocyanine cage (SubPc-cage), which performs as a catalytic molecular reactor that provides a beneficial hydrophobic environment. Negatively and positively charged anthracenes do not react either with C60 or C70, due to a favored solvation in water medium and/or to detrimental interactions with positively-charged Pd(II) corners of SubPc-cage. Experiments with C60 and C70 rendered parallel results, although C70 proved more reactive, leading to anthracene cycloadducts by reaction in the α bonds. All the results have been rationalized by theoretical calculations at the GFN2-xTB level ; Financial support from the Spanish MCIN/AEI/10.13039/ 501100011033 (PID2020-116490GB-I00, PID2020115801RB-C21, TED2021-131255B-C43), the Comunidad de Madrid and the Spanish State through the Recovery, Transformation and Resilience Plan [Materiales Disruptivos Bidimensionales (2D) (MAD2D-CM) (UAM1)-MRR Materiales Avanzados], and the European Union through the Next Generation EU funds is acknowledged. IMDEA Nanociencia acknowledges support from the “Severo Ochoa” Programme for Centres of Excellence in R&D (MINECO, Grant SEV2016-0686 |
| نوع الوثيقة: | article in journal/newspaper |
| وصف الملف: | application/pdf |
| اللغة: | English |
| Relation: | Advanced Synthesis and Catalysis (ASC); https://doi.org/10.1002/adsc.202301336; Gobierno de España. PID2020-116490GB-I00; Gobierno de España. PID2020-115801RB-C21; Gobierno de España. TED2021-131255B-C43; Comunidad de Madrid. S2013/MIT‐3007/MAD2D-CM; info:eu-repo/grantAgreement/EC/H2020101028059/EU//DyeMetalloCage; https://doi.org/10.21950/9MBDR9; Advanced Synthesis and Catalysis 366.4 (2024): 934–941; http://hdl.handle.net/10486/711384; 934; 941; 366 |
| DOI: | 10.1002/adsc.202301336 |
| الاتاحة: | http://hdl.handle.net/10486/711384 https://doi.org/10.1002/adsc.202301336 |
| Rights: | © 2024 The Authors ; Reconocimiento – NoComercial ; openAccess |
| رقم الانضمام: | edsbas.545251D4 |
| قاعدة البيانات: | BASE |
| DOI: | 10.1002/adsc.202301336 |
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