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2021

A three-shell supramolecular complex enables the symmetry-mismatched chemo- and regioselective bis-functionalization of C60

Authors: Ernest Ubasart, Oleg Borodin, Carles Fuertes-Espinosa, Youzhi Xu, Cristina García-Simón, Laura Gómez, Judith Juanhuix, Felipe Gándara, Inhar Imaz, Daniel Maspoch, Max von Delius, Xavi Ribas

Nature Chemistry, 2021, 13, 5, 420-427

DOI: 10.1038/s41557-021-00658-6

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

Cage–···Cage– Interaction: Boron Cluster-Based Noncovalent Bond and Its Applications in Solid-State Materials

Authors: Deshuang Tu, Jiaxin Li, Fangxiang Sun, Hong Yan, Jordi Poater, Miquel Solà

JACS Au, 2021, 1, 11, 2047-2057

DOI: 10.1021/jacsau.1c00348

Keywords: Aromaticity, Chemical bonding, Nanocages, Supramolecular chemistry

Photoinduced electron transfer in non-covalent complexes of C60 and phosphangulene oxide derivatives

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

Dalton Transactions, 2021, 50, 44, 16214-16222

DOI: 10.1039/d1dt02034j

Keywords: Electron and energy transfer, Fullerenes, Photochemistry, Photovoltaic materials, Supramolecular chemistry

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

Photoinduced electron transfer in nano-Saturn complexes of fullerene

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

Physical Chemistry Chemical Physics, 2021, 23, 3, 2126-2133

DOI: 10.1039/d0cp05919f

Keywords: Chemical bonding, Electron and energy transfer, Fullerenes, Photovoltaic materials, Supramolecular chemistry

An unprecedented π-electronic circuit involving an odd number of carbon atoms in a grossly warped non-planar nanographene

Authors: Sílvia Escayola, Albert Poater, Alvaro Muñoz-Castro, Miquel Solà

Chemical Communications, 2021, 57, 25, 3087-3090

DOI: 10.1039/d1cc00593f

Keywords: Aromaticity, Chemical bonding, Electron delocalization, 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

Effect of Alkali Metal Cations on Length and Strength of Hydrogen Bonds in DNA Base Pairs

Authors: Olga A. Stasyuk, Miquel Solà, Marcel Swart, Célia Fonseca Guerra, Tadeusz Marek Krygowski, Halina Szatylowicz

ChemPhysChem, 2020, 21, 18, 2112-2126

DOI: 10.1002/cphc.202000434

Keywords: Chemical bonding, Computational chemistry, Density Functional Theory, Supramolecular chemistry

Triquinoline‐ versus Fullerene‐Based Cycloparaphenylene Ionic Complexes: Comparison of Photoinduced Charge‐Shift Reactions

Authors: Anton J. Stasyuk, Olga A. Stasyuk, Miquel Solà, Alexander A. Voityuk

Chemistry – A European Journal, 2020, 26, 47, 10896-10902

DOI: 10.1002/chem.202002179

Keywords: Electron and energy transfer, Fullerenes, Photovoltaic materials, Supramolecular chemistry

Predictable Selectivity in Remote C−H Oxidation of Steroids: Analysis of Substrate Binding Mode

Authors: Giorgio Olivo, Giorgio Capocasa, Barbara Ticconi, Osvaldo Lanzalunga, Stefano Di Stefano, Miquel Costas

Angewandte Chemie International Edition, 2020, 59, 31, 12703-12708

DOI: 10.1002/anie.202003078

Keywords: Catalysis, High-valent metal complexes, Oxidation, Predictive Chemistry, Supramolecular chemistry

MOF Encapsulation of Ru Olefin Metathesis Catalysts to Block Catalyst Decomposition

Authors: Gerard Pareras, Davide Tiana, Albert Poater

Catalysts, 2020, 10, 6, 687

DOI: 10.3390/catal10060687

Keywords: Catalysis, Chemical bonding, Computational chemistry, Predictive Chemistry, Supramolecular chemistry

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

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

Protein-directed crystalline 2D fullerene assemblies

Authors: Mantas Liutkus, Alicia López-Andarias, Sara H. Mejías, Javier López-Andarias, David Gil-Carton, Ferran Feixas, Sílvia Osuna, Wakana Matsuda, Tsuneaki Sakurai, Shu Seki, Carmen Atienza, Nazario Martín, Aitziber L. Cortajarena

Nanoscale, 2020, 12, 6, 3614-3622

DOI: 10.1039/c9nr07083d

Keywords: Computational chemistry, Enzyme design, Fullerenes, Supramolecular chemistry

Substituted adenine quartets: interplay between substituent effect, hydrogen bonding, and aromaticity

Authors: Halina Szatylowicz, Paulina H. Marek, Olga A. Stasyuk, Tadeusz M. Krygowski, Miquel Solà

RSC Advances, 2020, 10, 39, 23350-23358

DOI: 10.1039/d0ra04585c

Keywords: Aromaticity, Chemical bonding, Supramolecular chemistry

2019

The Irony of Manganocene: An Interplay between the Jahn–Teller Effect and Close-Lying Electronic and Spin States

Authors: Stepan Stepanović, Matija Zlatar, Marcel Swart, Maja Gruden

Journal of Chemical Information and Modeling, 2019, 59, 5, 1806-1810

DOI: 10.1021/acs.jcim.8b00870

Keywords: Chemical bonding, Computational chemistry, Spin states, Supramolecular chemistry

Study of the effect of the ligand structure on the catalytic activity of Pd@ ligand decorated halloysite: Combination of experimental and computational studies

Authors: Sevda Dehghani, Samahe Sadjadi, Naeimeh Bahri‐Laleh, Mehdi Nekoomanesh‐Haghighi, Albert Poater

Applied Organometallic Chemistry, 2019, 33, 5

DOI: 10.1002/aoc.4891

Keywords: Catalysis, Computational chemistry, Organometallics, Supramolecular chemistry, Sustainable catalysis

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

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