maria.besora@urv.cat
BESORA BONET, MARIA
iMarina ID: 04-325087Departament
Química Física i Inorgànica. Universitat Rovira i Virgili. Tarragona
Grup
Química Quàntica (2017 SGR 00629). Universitat Rovira i Virgili. Tarragona
Codis d'identificació
Cronologia
novembre de 2005
Doctorat: Theoretical and Computational Chemistry
Universitat Autònoma de Barcelona
juliol de 2000
Titulat superior / Grau: Chemistry Bachelor
Universitat Autònoma de Barcelona
Cronologia
novembre de 2018
Personal investigador d'accés al SECTI
Universitat Rovira i Virgili. Química Física i Inorgànica
2018 - 2021
novembre de 2018
Personal investigador d'accés al SECTI. Química Física i Inorgànica
Universitat Rovira i Virgili
2018 - 2020
desembre de 2011
Postdoctoral Researcher. FUNDACIO PRIVADA INSTITUT CATALA D'INVESTIGACIO QUIMICA (ICIQ)
Fundació Privada Institut Català d'Investigació Química (ICIQ)
2011 - 2018
juliol de 2011
Professorat Visitant. Química Física i Inorgànica
Universitat Rovira i Virgili
2011 - 2014
desembre de 2008
Juan de la Cierva Postdoctoral Researcher. FUNDACIO PRIVADA INSTITUT CATALA D'INVESTIGACIO QUIMICA (ICIQ)
Fundació Privada Institut Català d'Investigació Química (ICIQ)
2008 - 2011
setembre de 2008
Postdoctoral Researcher. UNIVERSITY OF BRISTOL
University of Bristol
2008 - 2008
setembre de 2006
Postdoctoral Fellow Beatriu de Pinós. UNIVERSITY OF BRISTOL
University of Bristol
2006 - 2008
setembre de 2005
Fellow holder. Universitat Autònoma de Barcelona
Universitat Autònoma de Barcelona
2005 - 2006
setembre de 2004
Teaching assistant. Universitat Autònoma de Barcelona
Universitat Autònoma de Barcelona
2004 - 2005
setembre de 2001
Teaching assistant A.4.6. Universitat Autònoma de Barcelona
Universitat Autònoma de Barcelona
2001 - 2003
febrer de 2001
Teaching assistant A.3.6. Universitat Autònoma de Barcelona
Universitat Autònoma de Barcelona
2001 - 2002
setembre de 2000
Teaching assistant A.2.6. Universitat Autònoma de Barcelona
Universitat Autònoma de Barcelona
2000 - 2001
Reconeixements Investigació
Reconeixements Docents
Transferència
Temàtiques més freqüents
Temáticas
Projectes participats
Direcció y participació en projectes
IP
NO IP
Grups, xarxes
Química Quàntica (2017 SGR 00629)
Activitat docent
Centres
Universitat Autònoma de Barcelona
Universitat Rovira i Virgili
Assignatura/Curs
Publicacions en Altmetrics
| 2020 | A Quantitative Model for Alkane Nucleophilicity Based on C-H Bond Structural/Top... | |
| 2020 | Intermolecular Allene Functionalization by Silver-Nitrene Catalysis | |
| 2020 | On the Structure of Intermediates in Enyne Gold(I)-Catalyzed Cyclizations: Forma... | |
| 2020 | The Challenge of Reproducing with Calculations Raw Experimental Kinetic Data for... | |
| 2019 | The diverse mechanisms for the oxidative addition of C-Br bonds to Pd(PR3) and P... | |
| 2019 | Mechanistic Study on the Asymmetric Synthesis of the Wieland-Miescher Ketone and... | |
| 2018 | Computational Description of a Huisgen Cycloaddition Inside a Self-Assembled Nan... | |
| 2018 | Measuring the Relative Reactivity of the Carbon–Hydrogen Bonds of Alkanes as Nuc... | |
| 2018 | Microkinetic modeling in homogeneous catalysis | |
| 2018 | Calculation of Reaction Free Energies in Solution: A Comparison of Current Appro... | |
| 2018 | Copper-mediated reduction of azides under seemingly oxidising conditions: Cataly... | |
| 2018 | Computationally guided design of a readily assembled phosphite-thioether ligand ... | |
| 2018 | Searching for Hidden Descriptors in the Metal-Ligand Bond through Statistical An... | |
| 2017 | Mechanistic studies on gold-catalyzed direct arene c-h bond functionalization by... | |
| 2016 | Computational Characterization of the Origin of Selectivity in Cycloaddition Rea... | |
| 2015 | A computational view on the reactions of hydrocarbons with coinage metal complex... | |
| 2015 | Computational Study on the Mechanism of the Acceleration of 1,3-Dipolar Cycloadd... | |
| 2014 | Gold(I) carbenes by retro-buchner reaction: Generation and fate | |
| 2014 | Silver-catalyzed functionalization of esters by carbene transfer: The role of yl... | |
| 2014 | Catalytic copper-mediated ring opening and functionalization of benzoxazoles | |
| 2014 | Reaction of alkynes and azides: Not triazoles through copper-acetylides but oxaz... | |
| 2013 | Oxidative additions of aryl halides to palladium proceed through the monoligated... | |
| 2012 | A computational study on the intriguing mechanisms of the gas-phase thermal acti... | |
| 2011 | The importance of conformational search: A test case on the catalytic cycle of t... | |
| 2011 | Phosphine and solvent effects on oxidative addition of CH3Br to Pd(PR3) and Pd(P... | |
| 2010 | Mechanism for hydride-assisted rearrangement from ethylidene to ethylene in irid... | |
| 2010 | Competitive and selective Csp3-Br versus Csp2-Br bond activation in palladium-ca... | |
| 2010 | Computational study of (PBu3)-Bu-t as ligand in the palladium-catalysed aminatio... | |
| 2009 | Protonation of transition-metal hydrides: A not so simple process | |
| 2009 | SPIN-STATE CHANGES AND REACTIVITY IN TRANSITION METAL CHEMISTRY: REACTIVITY OF I... | |
| 2009 | A Combined Theoretical and Experimental Study on the Role of Spin States in the ... | |
| 2008 | On the origin of α- And β-agostic distortions in early-transition-metal alkyl co... | |
| 2008 | Effect of the Nature of the Metal Atom on Hydrogen Bonding and Proton Transfer t... | |
| 2008 | Coordination modes and hydride exchange dynamics in transition metal tetrahydrob... | |
| 2008 | Understanding the rate of spin-forbidden thermolysis of HN(3) and CH(3)N(3) | |
| 2008 | Computational analysis of amine-borane adducts as potential hydrogen storage mat... | |
| 2006 | Silyl, hydrido silylene or alternative bonding modes: The many possible structur... | |
| 2006 | Structure and bonding in a cyclobutyl tris(pyrazolyl)boratoniobium complex and t... | |
| 2006 | Hydrogen bonding and proton transfer to the trihydride complex [Cp*MoH3(dppe)]: ... | |
| 2004 | The Effect of the Inert Counteranions in the Deprotonation of the Dihydrogen Com... | |
| 2004 | First investigation of non-classical dihydrogen bonding between an early transit... | |
| 2003 | Bond energy M-C/H-C correlations: Dual theoretical and experimental approach to ... | |
| 2003 | Influence of media and homoconjugate pairing on transition metal hydride protona... | |
| 2003 | Some critical issues in the application of quantum mechanics/molecular mechanics... | |
| 2003 | Hydrogen bonding and proton transfer involving the trihydride complexes Cp*M(dpp... | |
| 2002 | Silyl, hydrido-silylene, or other bonding modes: Some unusual structures of [(dh... |
Col·laboracions institucionals darrers 5 anys
