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2021

Photoinduced electron transfer in mechanically interlocked suit[3]ane systems

Authors: A. J. Stasyuk, O. A. Stasyuk, M. Solà, A. A. Voityuk

Journal of Materials Chemistry C, 2021, 9, 30, 9436-9445

DOI: 10.1039/d1tc01673c

Keywords: Electron and energy transfer, Excited states, Nanocages, Photovoltaic materials, Supramolecular chemistry

Straightforward supramolecular purification of C84 from a fullerene extract

Authors: Ernest Ubasart, Cristina García-Simón, Míriam Pujals, Karam Asad, Nikos Chronakis, Teodor Parella, Xavi Ribas

Organic Chemistry Frontiers, 2021, 8, 15, 4101-4105

DOI: 10.1039/d1qo00597a

Keywords: Fullerenes, Nanocages, Supramolecular chemistry

2020

Complete Dynamic Reconstruction of C60, C70, and (C59N)2 Encapsulation into an Adaptable Supramolecular Nanocapsule

Authors: Cristina García-Simón, Cédric Colomban, Yarkin Aybars Çetin, Ana Gimeno, Míriam Pujals, Ernest Ubasart, Carles Fuertes-Espinosa, Karam Asad, Nikos Chronakis, Miquel Costas, Jesús Jiménez-Barbero, Ferran Feixas, Xavi Ribas

Journal of the American Chemical Society, 2020, 142, 37, 16051-16063

DOI: 10.1021/jacs.0c07591

Keywords: Computational chemistry, Fullerenes, Method development, Nanocages, Supramolecular chemistry

Too Persistent to Give Up: Aromaticity in Boron Clusters Survives Radical Structural Changes

Authors: Jordi Poater, Clara Viñas, Ines Bennour, Sílvia Escayola, Miquel Solà, Francesc Teixidor

Journal of the American Chemical Society, 2020, 142, 20, 9396-9407

DOI: 10.1021/jacs.0c02228

Keywords: Aromaticity, Chemical bonding, Electron delocalization, Nanocages, Organometallics

Computational NMR Spectra of o‐Benzyne and Stable Guests and Their Hemicarceplexes

Authors: Abril C. Castro, Adrian Romero‐Rivera, Sílvia Osuna, K. N. Houk, Marcel Swart

Chemistry – A European Journal, 2020, 26, 12, 2626-2634

DOI: 10.1002/chem.201904756

Keywords: Computational chemistry, Confined space, Nanocages, Spectroscopy, Supramolecular chemistry

Do Carbon Nano‐onions Behave as Nanoscopic Faraday Cages? A Comparison of the Reactivity of C60, C240, C60@C240, Li+@C60, Li+@C240, and Li+@C60@C240

Authors: Jesús Antonio Luque‐Urrutia, Albert Poater, Miquel Solà

Chemistry – A European Journal, 2020, 26, 4, 804-808

DOI: 10.1002/chem.201904650

Keywords: Catalysis, Confined space, Fullerenes, Nanocages, Reaction mechanisms

Supramolecular Fullerene Sponges as Catalytic Masks for Regioselective Functionalization of C60

Authors: Carles Fuertes-Espinosa, Cristina García-Simón, Míriam Pujals, Marc Garcia-Borràs, Laura Gómez, Teodor Parella, Judit Juanhuix, Inhar Imaz, Daniel Maspoch, Miquel Costas, Xavi Ribas

Chem, 2020, 6, 1, 169-186

DOI: 10.1016/j.chempr.2019.10.010

Keywords: Confined space, Fullerenes, Nanocages, Spectroscopy, Supramolecular chemistry

2019

Highly Strained, Radially π-Conjugated Porphyrinylene Nanohoops

Authors: Youzhi Xu, Sebastian Gsänger, Martin B. Minameyer, Inhar Imaz, Daniel Maspoch, Oleksandr Shyshov, Fabian Schwer, Xavi Ribas, Thomas Drewello, Bernd Meyer, Max von Delius

Journal of the American Chemical Society, 2019, 141, 46, 18500-18507

DOI: 10.1021/jacs.9b08584

Keywords: Aromaticity, Confined space, Fullerenes, Nanocages, Supramolecular chemistry

Size-selective encapsulation of C60 and C60-derivatives within an adaptable naphthalene-based tetragonal prismatic supramolecular nanocapsule

Authors: Cristina García-Simón, Alba Monferrer, Marc Garcia-Borràs, Inhar Imaz, Daniel Maspoch, Miquel Costas, Xavi Ribas

Chemical Communications, 2019, 55, 6, 798-801

DOI: 10.1039/c8cc07886f

Keywords: Confined space, Fullerenes, Nanocages, Supramolecular chemistry

Highly selective encapsulation and purification of U-based C78-EMFs within a supramolecular nanocapsule

Authors: Carles Fuertes-Espinosa, Jesse Murillo, Marco E. Soto, Maira R. Ceron, Roser Morales-Martínez, Antonio Rodríguez-Fortea, Josep M. Poblet, Luis Echegoyen, Xavi Ribas

Nanoscale, 2019, 11, 47, 23035-23041

DOI: 10.1039/c9nr07660c

Keywords: Confined space, Endohedral fullerenes, Fullerenes, Nanocages, Supramolecular chemistry

A flexible self-folding receptor for coronene

Authors: David Lozano, Rubén Álvarez-Yebra, Ricard López-Coll, Agustí Lledó

Chemical Science, 2019, 10, 44, 10351-10355

DOI: 10.1039/c9sc03158h

Keywords: Aromaticity, Computational chemistry, Confined space, Nanocages, Supramolecular chemistry

2018

Purification of Uranium‐based Endohedral Metallofullerenes (EMFs) by Selective Supramolecular Encapsulation and Release

Authors: Carles Fuertes‐Espinosa, Alejandra Gómez‐Torres, Roser Morales‐Martínez, Antonio Rodríguez‐Fortea, Cristina García‐Simón, Felipe Gándara, Inhar Imaz, Judith Juanhuix, Daniel Maspoch, Josep M. Poblet, Luis Echegoyen, Xavi Ribas

Angewandte Chemie International Edition, 2018, 57, 35, 11294-11299

DOI: 10.1002/anie.201806140

Keywords: Endohedral fullerenes, Fullerenes, Nanocages, Supramolecular chemistry

Covalent and Ionic Capacity of MOFs To Sorb Small Gas Molecules

Authors: Jordi Poater, Martí Gimferrer, Albert Poater

Inorganic Chemistry, 2018, 57, 12, 6981-6990

DOI: 10.1021/acs.inorgchem.8b00670

Keywords: Confined space, Density Functional Theory, Nanocages, Predictive Chemistry, Supramolecular chemistry

Self‐Assembled Cofacial Zinc–Porphyrin Supramolecular Nanocapsules as Tuneable 1O2 Photosensitizers

Authors: Cédric Colomban, Carles Fuertes‐Espinosa, Sébastien Goeb, Marc Sallé, Miquel Costas, Lluís Blancafort, Xavi Ribas

Chemistry – A European Journal, 2018, 24, 17, 4371-4381

DOI: 10.1002/chem.201705531

Keywords: Fullerenes, Light-driven synthesis, Nanocages, Photochemistry, Supramolecular chemistry

Reliable charge assessment on encapsulated fragment for endohedral systems

Authors: A. J. Stasyuk, M. Solà, A. A. Voityuk

Scientific Reports, 2018, 8, 1

DOI: 10.1038/s41598-018-21240-0

Keywords: Chemical bonding, Density Functional Theory, Endohedral fullerenes, Nanocages

Regioselectivity of the Pauson–Khand reaction in single-walled carbon nanotubes

Authors: Juan Pablo Martínez, María Vizuete, Luis M. Arellano, Albert Poater, F. Matthias Bickelhaupt, Fernando Langa, Miquel Solà

Nanoscale, 2018, 10, 31, 15078-15089

DOI: 10.1039/c8nr03480j

Keywords: Catalysis, Computational chemistry, Density Functional Theory, Nanocages, Organometallics

The electronic structure and stability of germanium tubes Ge30H12and Ge33H12

Authors: Long Van Duong, Eduard Matito, Miquel Solà, Hadi Behzadi, Mohammad Jafar Momeni, Minh Tho Nguyen

Physical Chemistry Chemical Physics, 2018, 20, 36, 23467-23479

DOI: 10.1039/c8cp03737j

Keywords: Aromaticity, Chemical bonding, Density Functional Theory, Electron delocalization, Nanocages

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