Publicacións (93) Publicacións de MARIA ISABEL MENENDEZ RODRIGUEZ

2024

  1. Elucidation of the Pyridine Ring-Opening Mechanism of 2,2′-Bipyridine or 1,10-Phenanthroline Ligands at Re(I) Carbonyl Complexes

    Inorganic Chemistry, Vol. 63, Núm. 19, pp. 8593-8603

  2. N-Tosylhydrazones as [N,N] Synthons in Heterocyclic Chemistry: Synthesis of 3,5-Disubstituted N-Alkenyl-1H-pyrazoles

    Advanced Synthesis and Catalysis

2023

  1. Electron Number Distribution Functions

    Comprehensive Computational Chemistry, First Edition: Volume 1-4 (Elsevier), pp. V2-28-V2-54

  2. Near-infrared absorption of fused core-modified expanded porphyrins for dye-sensitized solar cells

    The Journal of chemical physics, Vol. 158, Núm. 16

2022

  1. A novel antibacterial benzimidazolium hexachlorotellurate hybrid compound: Experimental-theoretical characterization

    Polyhedron, Vol. 228

  2. Computational Design of Rhenium(I) Carbonyl Complexes for Anticancer Photodynamic Therapy

    Inorganic Chemistry, Vol. 61, Núm. 1, pp. 439-455

2021

  1. Experimental and theoretical investigation of the catalytic performance of reduced Schiff base and Schiff base iron complexes: Transformation to magnetically retrievable catalyst

    Applied Organometallic Chemistry, Vol. 35, Núm. 9

2020

  1. Addition of Re-Bonded Nucleophilic Ligands to Activated Alkynes: A Theoretical Rationalization

    European Journal of Inorganic Chemistry, Vol. 2020, Núm. 3, pp. 269-280

  2. Catalytic hydration of cyanamides with phosphinous acid-based ruthenium(ii) and osmium(ii) complexes: scope and mechanistic insights

    Catalysis Science and Technology, Vol. 10, Núm. 12, pp. 4084-4098

  3. Influence of the nucleophilic ligand on the reactivity of carbonyl rhenium(I) complexes towards methyl propiolate: A computational chemistry perspective

    Molecules, Vol. 25, Núm. 18

  4. Iron Complexes Anchored onto Magnetically Separable Graphene Oxide Sheets: An Excellent Catalyst for the Synthesis of Dihydroquinazoline-Based Compounds

    ACS Applied Materials and Interfaces, Vol. 12, Núm. 34, pp. 38530-38545

2019

  1. Assessment of BODIPY-Oxasmaragdyrin Dyads for Dye-Sensitized Solar Cells: Aromaticity, Photosensitization Capability, and Charge Transport

    Journal of Physical Chemistry C, Vol. 123, Núm. 32, pp. 19362-19375

  2. Gold(I)-catalyzed intermolecular dioxolane addition to alkynes: the role of water

    Theoretical Chemistry Accounts, Vol. 138, Núm. 5

  3. Regiochemistry Control by Bipyridine Substituents in the Deprotonation of ReI and MoII N-Alkylimidazole Complexes

    Chemistry - A European Journal, Vol. 25, Núm. 39, pp. 9253-9265

  4. Surfactant-mediated solubilization of magnetically separable nanocatalysts for the oxidation of alcohols

    ACS Omega, Vol. 4, Núm. 7, pp. 11558-11565

  5. [Cp2Mo(OH)(OH2)]+-Catalyzed Hydrolysis of Mono- and Difunctional Ethers: Theoretical Understanding of Their Divergent Reactivity

    European Journal of Inorganic Chemistry, Vol. 2019, Núm. 24, pp. 2924-2932

2018

  1. Torquoselective Mechanochemical Activation of the Staudinger Reaction to Form β-Lactams

    Journal of Organic Chemistry, Vol. 83, Núm. 4, pp. 2438-2441

2017

  1. A route to magnetically separable nanocatalysts: Combined experimental and theoretical investigation of alkyl substituent role in ligand backbone towards epoxidation ability

    Applied Organometallic Chemistry, Vol. 31, Núm. 8

  2. Insights on the Reactivity of Terminal Phosphanido Metal Complexes toward Activated Alkynes from Theoretical Computations

    Inorganic Chemistry, Vol. 56, Núm. 11, pp. 6652-6661

  3. Oxidation of Organic Functionalities by PhI(OAc)2 Catalysed by Magnetically Separable Fe3O4@dopa-Supported Mn(III) Complexes: Combined Experimental and Theoretical Approach

    ChemistrySelect, Vol. 2, Núm. 27, pp. 8686-8700