Publications by the researcher in collaboration with DANIEL ALVAREZ LORENZO (8)

2022

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

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

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

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. 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

  3. [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

2017

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

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