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2025

Catalyst‐Directed Selectivity in Vinylcarbene Reactions: A Comparative Study of Ag, Rh, and Cu Complexes

Authors: Roger Monreal‐Corona, Àlex Díaz‐Jiménez, Pedro J. Pérez, Ana Caballero, Anna Roglans, Albert Poater, Anna Pla‐Quintana

Advanced Synthesis & Catalysis, 2025, 367, 15

DOI: 10.1002/adsc.70007

Keywords: Chemical bonding, Cycloaddition, Organometallics, Predictive Chemistry, Reaction mechanisms

Diels–Alder Cycloaddition of Cyclopentadiene to C60 and Si60 and Their Endohedral Li+ Counterparts

Authors: Omkar Charapale, Jordi Poater, Sergio Posada-Pérez, Miquel Solà, Albert Poater

The Journal of Physical Chemistry A, 2025, 129, 5, 1386-1395

DOI: 10.1021/acs.jpca.4c08287

Keywords: Cycloaddition, Reaction mechanisms, Regioselectivite functionalization

On the Functionalization of C60 with Vinylallenes Generated in situ by Rhodium Catalysis

Authors: Cristina Castanyer, Albert Artigas, Miquel Solà, Anna Pla‐Quintana, Anna Roglans

Advanced Synthesis & Catalysis, 2025, 367, 4

DOI: 10.1002/adsc.202401163

Keywords: Cycloaddition, Homogeneous catalysis, Organometallics, Reaction mechanisms, Regioselectivite functionalization

2024

From Stilbenes to carbo‐Stilbenes: an Encouraging Prospect

Authors: Chongwei Zhu, Alix Saquet, Valérie Maraval, Christian Bijani, Xiuling Cui, Albert Poater, Remi Chauvin

Chemistry – A European Journal, 2024, 30, 26

DOI: 10.1002/chem.202400451

Keywords: Aromaticity, Chemical bonding, Computational chemistry, Cycloaddition, Excited states

Synthesis of 1H-Isoindole-Containing Scaffolds Enabled by a Nitrile Trifunctionalization

Authors: Àlex Díaz-Jiménez, Roger Monreal-Corona, Miquel Solà, Albert Poater, Anna Roglans, Anna Pla-Quintana

ACS Catalysis, 2024, 14, 10, 7381-7388

DOI: 10.1021/acscatal.4c00932

Keywords: Cycloaddition, Homogeneous catalysis, Organometallics, Reaction mechanisms, Regioselectivite functionalization

Biocatalytic strategy for the construction of sp3-rich polycyclic compounds from directed evolution and computational modelling

Authors: David A. Vargas, Xinkun Ren, Arkajyoti Sengupta, Ledong Zhu, Satyajit Roy, Marc Garcia-Borràs, K. N. Houk, Rudi Fasan

Nature Chemistry, 2024, 16, 5, 817-826

DOI: 10.1038/s41557-023-01435-3

Keywords: Biocatalysis, Computational chemistry, Cycloaddition, Enzyme design, Reaction mechanisms

Regioswitchable Bingel Bis-Functionalization of Fullerene C70 via Supramolecular Masks

Authors: Valentina Iannace, Clara Sabrià, Youzhi Xu, Max von Delius, Inhar Imaz, Daniel Maspoch, Ferran Feixas, Xavi Ribas

Journal of the American Chemical Society, 2024, 146, 8, 5186-5194

DOI: 10.1021/jacs.3c10808

Keywords: Confined space, Cycloaddition, Molecular Dynamics interactions, Nanocages, Regioselectivite functionalization

Rh‐Catalyzed Cycloaddition of C60 with Enynes: Unveiling the Mechanistic Pathway

Authors: Cristina Castanyer, Albert Artigas, Nil Insa‐Carreras, Miquel Solà, Anna Pla‐Quintana, Anna Roglans

Advanced Synthesis & Catalysis, 2024, 366, 4, 862-869

DOI: 10.1002/adsc.202301189

Keywords: Cycloaddition, Joint Exp-Comp, Organometallics, Photovoltaic materials, Reaction mechanisms

The Intermolecular Pauson‐Khand Reaction: Applications, Challenges, and Opportunities

Authors: Agustí Lledó, Jordi Solà

Advanced Synthesis & Catalysis, 2024, 366, 4, 574-592

DOI: 10.1002/adsc.202301236

Keywords: Cycloaddition, Homogeneous catalysis, Ligand design, Organometallics, Reaction mechanisms

Unveiling the regioselectivity of rhodium(I)-catalyzed [2 + 2 + 2] cycloaddition reactions for open-cage C70 production

Authors: Cristina Castanyer, Anna Pla-Quintana, Anna Roglans, Albert Artigas, Miquel Solà

Beilstein Journal of Organic Chemistry, 2024, 20, 272-279

DOI: 10.3762/bjoc.20.28

Keywords: Cycloaddition, Homogeneous catalysis, Joint Exp-Comp, Organometallics, Regioselectivite functionalization

[4+2]‐Cycloaddition Reactions to Corannulene Accelerated by η6‐Coordination of Ruthenium Complexes

Authors: Amir Lebcir, Abbes Boukhari, Miquel Solà, Yago García‐Rodeja

European Journal of Organic Chemistry, 2024, 27, 41

DOI: 10.1002/ejoc.202400697

Keywords: Cycloaddition, Homogeneous catalysis, Organometallics, Reaction mechanisms

Preserving precise choreography of bonds in Z-stereoretentive olefin metathesis by using quinoxaline-2,3-dithiolate ligand

Authors: Łukasz Grzesiński, Maryana Nadirova, Jannick Guschlbauer, Artur Brotons-Rufes, Albert Poater, Anna Kajetanowicz, Karol Grela

Nature Communications, 2024, 15, 1

DOI: 10.1038/s41467-024-52876-4

Keywords: Computational chemistry, Cycloaddition, Joint Exp-Comp, Organometallics, Reaction mechanisms

Enantio- and Diastereodivergent Cyclopropanation of Allenes by Directed Evolution of an Iridium-Containing Cytochrome

Authors: Brandon J. Bloomer, Isaac A. Joyner, Marc Garcia-Borràs, Derek B. Hu, Martí Garçon, Andrew Quest, Consuelo Ugarte Montero, Isaac F. Yu, Douglas S. Clark, John F. Hartwig

Journal of the American Chemical Society, 2024, 146, 3, 1819-1824

DOI: 10.1021/jacs.3c13011

Keywords: Biocatalysis, Computational chemistry, Cycloaddition, Enzyme design

Mechanistic insights into the rhodium catalysed dehydrogenative cycloaddition of cyano-yne-allene substrates

Authors: Àlex Díaz-Jiménez, Anna Roglans, Miquel Solà, Anna Pla-Quintana

Organic Chemistry Frontiers, 2024, 11, 13, 3655-3662

DOI: 10.1039/d4qo00378k

Keywords: Cycloaddition, Homogeneous catalysis, Joint Exp-Comp, Organometallics, Reaction mechanisms

2023

Copper(I) Iodide Catalyzed [3 + 3] Annulation of Iodonium Ylides with Pyridinium 1,4-Zwitterionic Thiolates for the Synthesis of 1,4-Oxathiin Scaffolds

Authors: Àlex Díaz-Jiménez, Stuart C. D. Kennington, Anna Roglans, Anna Pla-Quintana

Organic Letters, 2023, 25, 26, 4830-4834

DOI: 10.1021/acs.orglett.3c01538

Keywords: Cycloaddition, Homogeneous catalysis, Reaction mechanisms, Sustainable catalysis

Rh(I) Complexes with Hemilabile Thioether-Functionalized NHC Ligands as Catalysts for [2 + 2 + 2] Cycloaddition of 1,5-Bisallenes and Alkynes

Authors: Jordi Vila, Miquel Solà, Thierry Achard, Stéphane Bellemin-Laponnaz, Anna Pla-Quintana, Anna Roglans

ACS Catalysis, 2023, 13, 5, 3201-3210

DOI: 10.1021/acscatal.2c05790

Keywords: Catalysis, Cycloaddition, Density Functional Theory, Reaction mechanisms

Facile Construction of New Hybrid Conjugation via Boron Cage Extension

Authors: Fangxiang Sun, Shuaimin Tan, Hou-Ji Cao, Chang-sheng Lu, Deshuang Tu, Jordi Poater, Miquel Solà, Hong Yan

Journal of the American Chemical Society, 2023, 145, 6, 3577-3587

DOI: 10.1021/jacs.2c12526

Keywords: Aromaticity, Chemical bonding, Computational chemistry, Cycloaddition, Electron delocalization

The application of aromaticity and antiaromaticity to reaction mechanisms

Authors: Qin Zhu, Shuwen Chen, Dandan Chen, Lu Lin, Kui Xiao, Liang Zhao, Miquel Solà, Jun Zhu

Fundamental Research, 2023, 3, 6, 926-938

DOI: 10.1016/j.fmre.2023.04.004

Keywords: Aromaticity, Cycloaddition, Fullerenes, Reaction mechanisms

2022

3D and 2D aromatic units behave like oil and water in the case of benzocarborane derivatives

Authors: Jordi Poater, Clara Viñas, Miquel Solà, Francesc Teixidor

Nature Communications, 2022, 13, 1

DOI: 10.1038/s41467-022-31267-7

Keywords: Aromaticity, Chemical bonding, Cycloaddition, Electron delocalization

Nickel‐Catalyzed Csp2−OMe Functionalization for Chemoselective Aromatic Homologation En Route to Nanographenes

Authors: Lorena Capdevila, Judith Sala, Lutz Ackermann, Xavi Ribas

Chemistry – A European Journal, 2022, 28, 29

DOI: 10.1002/chem.202200625

Keywords: Catalysis, Cycloaddition, Organometallics, Reaction mechanisms, Sustainable catalysis

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