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Microkinetic modeling in homogeneous catalysis
Wiley Interdiscip Rev Comput Mol Sci. 2018, 8 (6), e1372, DOI: 10.1002/wcms.1372 . -
Enantioselective Synthesis of Aminodiols by Sequential Rhodium-Catalysed Oxyamination/Kinetic Resolution: Expanding the Substrate Scope of Amidine-Based Catalysis
CHEM-EUR J 2018, 24 (18), 4635-4642, DOI: 10.1002/chem.201705670 . -
Computational Description of a Huisgen Cycloaddition Inside a Self‐Assembled Nanocapsule
Eur. J. Org. Chem. 2018, 2018 (18), 2103-2109, DOI: 10.1002/ejoc.201800179. -
Elucidating the Mechanism of Aryl Aminations Mediated by NHC-Supported Nickel Complexes: Evidence for a Nonradical Ni(0)/Ni(II) Pathway
ACS Catal. 2018, 8 (5), 3733–3742, DOI: 10.1021/acscatal.8b00856. -
Copper-Catalyzed Borylative Ring Closing C-C Coupling toward Spiro- and Dispiroheterocycles
ACS Catal. 2018, 8 (4), 2833–2838, DOI: 10.1021/acscatal.8b00257. -
Calculation of Reaction Free Energies in Solution: A Comparison of Current Approaches
J. Phys. Chem. A, 2018, 122 (5), 1392–1399, DOI: 10.1021/acs.jpca.7b11580. -
Radical C-H-Amination of Heteroarenes using Dual Initiation by Visible Light and Iodine
Adv Synth Catal. 2018, 360 (20), 3889-3893, DOI: 10.1002/adsc.201800677. -
Organoboron donor-π-acceptor chromophores for small-molecule organic solar cells
J. Mater. Sci. Mater. Electron. 2018, 29 (19), 16410-16415, DOI: 10.1007/s10854-018-9732-6. -
Second-Generation Azafullerene Monoadducts as Electron Acceptors in Bulk Heterojunction Solar Cells
Synthesis 2018, 50 (4), 764-771, DOI: 10.1055/s-0036-1591871. -
Visible and near-infrared organic photosensitizers comprising isoindigo derivatives as chromophores: synthesis, optoelectronic properties and factors limiting their efficiency in dye solar cells
J. Mater. Chem. A 2018, 6, 10074-10084, DOI: 10.1039/C8TA01826J.