Data underlying the research of: E-selective Semi-hydrogenation of Alkynes by a Diruthenium Hydride Complex
doi:10.4121/20015018.v1
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doi: 10.4121/20015018
doi: 10.4121/20015018
Datacite citation style:
Danny Broere (2022): Data underlying the research of: E-selective Semi-hydrogenation of Alkynes by a Diruthenium Hydride Complex. Version 1. 4TU.ResearchData. dataset. https://doi.org/10.4121/20015018.v1
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Dataset
The files contain the Nuclear Magnetic Resonance spectra of all compounds reported and input/output files of the ORCA calculations within this publication. All files are processed MestReNova files, which are easily interpretable and can be used for facile comparison with locally produced spectra. Raw FIDs can readily be extracted with the same software.
history
- 2022-06-09 first online, published, posted
publisher
4TU.ResearchData
format
NMR Files are .mnova files that can be opened using the MestReNova program.
Files relating to the computations are .inp .out or .xyz files that can be opened using Notepad or any other text editing software
funding
- NWO STU.018-2.00
organizations
Utrecht University, Faculty of Science, Organic Chemistry & Catalysis group
DATA
files (2)
- 1,416 bytesMD5:
1df14399e435c49c7c9951dea90c64a9
README.txt - 187,654,034 bytesMD5:
2fa43d64f3b24e2d1d13434ee29d089c
Data_package.zip -
download all files (zip)
187,655,450 bytes unzipped