The DOI displayed above is for this specific version of this dataset, which is currently the latest. Newer versions may be published in the future. For a link that will always point to the latest version, please use
DOI: 10.4121/19190237

Tossaint, Alex; Rebreyend, Christophe; Sinha, Vivek; Weber, Manuela; Canossa, Stefano et. al. (2022): Raw data for "Two step activation of Ru-PN3P pincer catalysts for CO2 hydrogenation". Version 1. 4TU.ResearchData. dataset. https://doi.org/10.4121/19190237.v1

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Categories

• Physical Chemistry (incl. Structural)
• Organic Chemistry
• Theoretical and Computational Chemistry
• Inorganic Chemistry

Keywords

Catalyst Activation CO2 formic acid mechanisms pincer complex

Licence

CC BY-NC 4.0

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by Alex Tossaint, Christophe Rebreyend, Vivek Sinha, Manuela Weber , Stefano Canossa , Evgeny A. Pidko, Georgy Filonenko

This dataset contains raw NMR data for new compounds used in the publication. The contents are stored in MNOVA format and can be used as a reference for reproduction.
Dataset also contains raw DFT data for calculations presented in the research work, specifically on hydrogen activation and pincer ligand acidity topics.

History

• 2022-03-22 first online, published, posted

Publisher

4TU.ResearchData

Format

NMR data is in MNOVA format. DFT data is tabulated text, partially located in an archive

Associated peer-reviewed publication

Two step activation of Ru‐PN3P pincer catalysts for CO2 hydrogenation

Organizations

TU Delft, Faculty of Applied Sciences, Department of Chemical Engineering
Freie Universität Berlin, Instiut für Chemie und Biochemie, Anorganische Chemie
Max Planck Institute for Solid State Research, Stuttgart