Bidentate NHC-Containing Ligands for Copper Catalyzed Synthesis of Functionalized Diaryl Ethers with Low Catalyst Loading. Computational modelling

DOI: 10.14469/hpc/12929 Metadata

Created: 2023-07-29 07:50

Last modified: 2024-03-15 07:11

Author: Henry Rzepa

License: Creative Commons: Public Domain Dedication 1.0

Funding: (none given)

Co-author: Silvia Diez-Gonzalez
Co-author: Luis Casarrubios
Co-author: Silvia Diez-Gonzalez

Description

Gaussian 16 calculations for Bidentate NHC-Containing Ligands for Copper Catalyzed Synthesis of Functionalized Diaryl Ethers with Low Catalyst Loading. Tool for correcting pressure to concentration: https://planetcalc.com/7918/

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DOIDescription
10.14469/hpc/12829 Bidentate NHC-Containing Ligands for Copper Catalyzed Synthesis of Functionalized Diaryl Ethers with Low Catalyst Loading

Members

DOIDescription
10.14469/hpc/13524 FAIR Data Table. Activation energies and Geometries for Catalytic Ullmann reaction
10.14469/hpc/13922 Bidentate NHC-Containing Ligands for Copper Catalyzed Synthesis of Functionalized Diaryl Ethers with Low Catalyst Loading. DFT Methods.

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