Research Data Leeds Repository

Citation

Halcrow, Malcolm A. and Pask, Christopher M. and Greatorex, Sam and Kulmaczewski, Rafał and Baldansuren, Amgalanbaatar and McInnes, Eric J. L. and Bamiduro, Faith and Yamada, Mihoko and Yoshinari, Nobuto (2020) Data to support study of Elucidating the Structural Chemistry of a Hysteretic Iron(II) Spin-Crossover Compound From its Copper(II) and Zinc(II) Congeners. University of Leeds. [Dataset] https://doi.org/10.5518/773

Dataset description

Structurally different [ML2][BF4]2∙2H2O (L = 2,6-bis[5-methyl-1H-pyrazol-3-yl]pyridine; M = Fe, Cu or Zn) form the same anhydrous phase upon annealing, which transforms to one of two new phases near room temperature.

Keywords:	iron; copper; zinc; spin-crossover; X-ray diffraction; EPR spectroscopy
Subjects:	F000 - Physical sciences > F100 - Chemistry
Divisions:	Faculty of Engineering and Physical Sciences > School of Chemistry
Related resources:	Location Type https://doi.org/10.1002/chem.202000101 Publication http://eprints.whiterose.ac.uk/156475/ Publication
License:	Creative Commons Attribution 4.0 International (CC BY 4.0)
Date deposited:	07 Feb 2020 14:32
URI:	https://archive.researchdata.leeds.ac.uk/id/eprint/640
Additional details Additional details Creators or authors: Creators ORCID Other ID Email Primary affiliation Primary affiliation ID Primary affiliation ID type Secondary affiliation Secondary affiliation ID Secondary affiliation ID type Halcrow, Malcolm A. https://orcid.org/0000-0001-7491-9034 University of Leeds https://ror.org/024mrxd33 ror m.a.halcrow@leeds.ac.uk Malcolm Halcrow Pask, Christopher M. https://orcid.org/0000-0002-2241-5069 University of Leeds https://ror.org/024mrxd33 ror Greatorex, Sam University of Leeds https://ror.org/024mrxd33 ror Kulmaczewski, Rafał https://orcid.org/0000-0002-3855-4530 University of Leeds https://ror.org/024mrxd33 ror Baldansuren, Amgalanbaatar https://orcid.org/0000-0001-8767-3731 University of Manchester https://ror.org/027m9bs27 ror McInnes, Eric J. L. https://orcid.org/0000-0002-4090-7040 University of Manchester https://ror.org/027m9bs27 ror Bamiduro, Faith https://orcid.org/0000-0002-1914-5731 University of Leeds https://ror.org/024mrxd33 ror Yamada, Mihoko https://orcid.org/0000-0002-3789-6600 University of Osaka https://ror.org/035t8zc32 ror Yoshinari, Nobuto https://orcid.org/0000-0003-2457-0967 University of Osaka https://ror.org/035t8zc32 ror Type of data: Dataset Research funders: EPSRC, EPSRC, EPSRC Grant numbers: EP/M506552/1, EP/K012568/1, NS/A000055/1 Publication date: 2020 Resource language: English Metadata language: English Research project title: DTP grant to Leeds School of Chemistry, Switchable molecular crystals, EPR National Service (University of Manchester) Publisher: University of Leeds Contact email: m.a.halcrow@leeds.ac.uk Last Modified: 23 Jul 2024 13:43

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Documentation

compound naming and metadata [206kB] compound naming and metadata [206kB] compound naming and metadata [206kB] Security: Anyone File name: readme.pdf Content type: Documentation Mime-Type: application/pdf License: Creative Commons Attribution 4.0 International (CC BY 4.0) File size: 206kB

Data

CHN microanalysis [2MB] CHN microanalysis [2MB] CHN microanalysis [2MB] Security: Anyone File name: Microanalysis.pdf Content type: Data Mime-Type: application/pdf License: Creative Commons Attribution 4.0 International (CC BY 4.0) File size: 2MB

Thermogravimetric analysis [796kB] Thermogravimetric analysis [796kB] Thermogravimetric analysis [796kB] Security: Anyone File name: TGA.zip Content type: Data Mime-Type: application/zip License: Creative Commons Attribution 4.0 International (CC BY 4.0) File size: 796kB

Single crystal X-ray diffraction [6MB] Single crystal X-ray diffraction [6MB] Single crystal X-ray diffraction [6MB] Security: Anyone File name: crystal.zip Content type: Data Mime-Type: application/zip License: Creative Commons Attribution 4.0 International (CC BY 4.0) File size: 6MB

Magnetic susceptibility [303kB] Magnetic susceptibility [303kB] Magnetic susceptibility [303kB] Security: Anyone File name: magnetism.zip Content type: Data Mime-Type: application/zip License: Creative Commons Attribution 4.0 International (CC BY 4.0) File size: 303kB

Differential scanning calorimetry [1MB] Differential scanning calorimetry [1MB] Differential scanning calorimetry [1MB] Security: Anyone File name: DSC.zip Content type: Data Mime-Type: application/zip License: Creative Commons Attribution 4.0 International (CC BY 4.0) File size: 1MB

X-ray powder diffraction [5MB] X-ray powder diffraction [5MB] X-ray powder diffraction [5MB] Security: Anyone File name: XRPD.zip Content type: Data Mime-Type: XRPD.zip License: Creative Commons Attribution 4.0 International (CC BY 4.0) File size: 5MB

EPR spectra [21MB] EPR spectra [21MB] EPR spectra [21MB] Security: Anyone File name: EPR.zip Content type: Data Mime-Type: application/zip License: Creative Commons Attribution 4.0 International (CC BY 4.0) File size: 21MB