A flexible self-folding receptor for coronene

We report a conformationally flexible deep cavitand receptor based on calix[5]arene and stabilized by a cooperative network of hydrogen bonds. The receptor binds coronene selectively over smaller polycyclic aromatic hydrocarbons, but is flexible enough to adapt to a smaller guest that presents a com...

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Detalles Bibliográficos
Autores principales: Lozano, David, Álvarez-Yebra, Rubén, López-Coll, Ricard, Lledó, Agustí
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Royal Society of Chemistry 2019
Materias:
Chemistry
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6984329/
https://www.ncbi.nlm.nih.gov/pubmed/32110323
http://dx.doi.org/10.1039/c9sc03158h
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author Lozano, David
Álvarez-Yebra, Rubén
López-Coll, Ricard
Lledó, Agustí
author_facet Lozano, David
Álvarez-Yebra, Rubén
López-Coll, Ricard
Lledó, Agustí
author_sort Lozano, David
collection PubMed
description We report a conformationally flexible deep cavitand receptor based on calix[5]arene and stabilized by a cooperative network of hydrogen bonds. The receptor binds coronene selectively over smaller polycyclic aromatic hydrocarbons, but is flexible enough to adapt to a smaller guest that presents a complementary electron deficient surface. The unique dynamic properties of this system have been thoroughly studied by NMR spectroscopy and molecular dynamics (MD) simulations.
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spelling pubmed-69843292020-02-27 A flexible self-folding receptor for coronene Lozano, David Álvarez-Yebra, Rubén López-Coll, Ricard Lledó, Agustí Chem Sci Chemistry We report a conformationally flexible deep cavitand receptor based on calix[5]arene and stabilized by a cooperative network of hydrogen bonds. The receptor binds coronene selectively over smaller polycyclic aromatic hydrocarbons, but is flexible enough to adapt to a smaller guest that presents a complementary electron deficient surface. The unique dynamic properties of this system have been thoroughly studied by NMR spectroscopy and molecular dynamics (MD) simulations. Royal Society of Chemistry 2019-09-23 /pmc/articles/PMC6984329/ /pubmed/32110323 http://dx.doi.org/10.1039/c9sc03158h Text en This journal is © The Royal Society of Chemistry 2019 http://creativecommons.org/licenses/by-nc/3.0/ This article is freely available. This article is licensed under a Creative Commons Attribution Non Commercial 3.0 Unported Licence (CC BY-NC 3.0)
spellingShingle Chemistry
Lozano, David
Álvarez-Yebra, Rubén
López-Coll, Ricard
Lledó, Agustí
A flexible self-folding receptor for coronene
title A flexible self-folding receptor for coronene
title_full A flexible self-folding receptor for coronene
title_fullStr A flexible self-folding receptor for coronene
title_full_unstemmed A flexible self-folding receptor for coronene
title_short A flexible self-folding receptor for coronene
title_sort flexible self-folding receptor for coronene
topic Chemistry
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6984329/
https://www.ncbi.nlm.nih.gov/pubmed/32110323
http://dx.doi.org/10.1039/c9sc03158h
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