Results: 14
SandeepKumar Thakur, Nil Roig, Roger Monreal-Corona, Jens Langer, Mercedes Alonso, Sjoerd Harder
Similarities and Differences in Benzene Reduction with Ca, Sr, Yb and Sm: Strong Evidence for Tetra‐Anionic Benzene
Angew Chem Int Ed, 2024, [], ASAP-
DOI: 10.1002/anie.202405229Keywords: Aromaticity, Chemical bonding
Luis Leyva-Parra, Ricardo Pino-Rios, Diego Inostroza, Miquel Solà, Mercedes Alonso, William Tiznado
Aromaticity and Magnetic Behavior in Benzenoids: Unraveling Ring Current Combinations
Chemistry A European J, 2024, [], ASAP-
DOI: 10.1002/chem.202302415Keywords: Aromaticity, Chemical bonding, Method development
Albert Artigas, Yannick Carissan, Denis Hagebaum-Reignier, Harald Bock, Fabien Durola, Yoann Coquerel
Aromaticity in Semi‐Condensed Figure‐Eight Molecules
Chemistry A European J, 2024, [], ASAP-
DOI: 10.1002/chem.202401016Keywords: Aromaticity
Chongwei Zhu, Alix Saquet, Valérie Maraval, Christian Bijani, Xiuling Cui, Albert Poater, Remi Chauvin
From Stilbenes tocarbo ‐Stilbenes: an Encouraging Prospect
Chemistry A European J, 2024, 30, ASAP-
DOI: 10.1002/chem.202400451Keywords: Aromaticity, Chemical bonding, Computational chemistry, Cycloaddition, Excited states
Joan Grèbol-Tomàs, Eduard Matito, Pedro Salvador
Can Aromaticity be Evaluated Using Atomic Partitions based on the Hilbert‐space?
Chemistry A European J, 2024, [], ASAP-
DOI: 10.1002/chem.202401282Keywords: Aromaticity, Computational chemistry, Method development
Eline Desmedt, Irene Casademont-Reig, Roger Monreal-Corona, Freija De Vleeschouwer, Mercedes Alonso
Aromaticity in the Spectroscopic Spotlight of Hexaphyrins
Chemistry A European J, 2024, [], ASAP-
DOI: 10.1002/chem.202401933Keywords: Aromaticity, Computational chemistry, Excited states, Spectroscopy
Roger Monreal-Corona, Anton J. Stasyuk, Miquel Solà, Anna Pla-Quintana, Albert Poater
Unveiling the reaction mechanisms of the synthesis and the excited state intramolecular proton transfer of 2‐(2′‐hydroxyphenyl)imidazo[1,2‐a ]pyridine
ChemPhysChem, 2024, [], ASAP-
DOI: 10.1002/cphc.202400069Keywords: Aromaticity, Excited states, Reaction mechanisms
Miquel Solà
Comprehensive Computational Chemistry (First Edition)
Elsevier, 2024, 2, 189-209
DOI: 10.1016/B978-0-12-821978-2.00061-1Keywords: Aromaticity, Chemical bonding, Excited states
Shengwen Xu, Hongjian Zhang, Jingkai Xu, Weiqun Suo, Chang-Sheng Lu, Deshuang Tu, Xingwei Guo, Jordi Poater, Miquel Solà, Hong Yan
Photoinduced Selective B–H Activation ofnido -Carboranes
J. Am. Chem. Soc., 2024, [], ASAP-
DOI: 10.1021/jacs.4c00550Keywords: Aromaticity, Electron and energy transfer, Excited states, Joint Exp-Comp, Reaction mechanisms
Cong-Cong Shu, Dariusz W. Szczepanik, Alvaro Muñoz-Castro, Miquel Solà, Zhong-Ming Sun
[K2 (Bi@Pd12 @Bi20 )]4– : An Endohedral Inorganic Fullerene with Spherical Aromaticity
J. Am. Chem. Soc., 2024, [], ASAP-
DOI: 10.1021/jacs.4c03024Keywords: Aromaticity, Chemical bonding, Joint Exp-Comp, Spin states