Research Data Leeds Repository

Data to support study of Spin States of Homochiral and Heterochiral Isomers of [Fe(PyBox)2]2+ Derivatives

Citation

Halcrow, Malcolm A. and Burrows, Kay E. and McGrath, Sarah E. and Kulmaczewski, Rafał and Cespedes, Oscar and Barrett, Simon A. (2017) Data to support study of Spin States of Homochiral and Heterochiral Isomers of [Fe(PyBox)2]2+ Derivatives. University of Leeds. [Dataset] https://doi.org/10.5518/184¹

Dataset description

Homochiral [Fe((R)-LPh)2]2+ (LPh = 2,6-bis{4-phenyloxazolinyl}pyridine) undergoes spin-crossover in CD3CN at 34 K lower temperature than its heterochiral diastereomer [Fe((R)-LPh)((S)-LPh)]2+.

Keywords:

iron; spin-crossover; isomers; chirality

Subjects:

F000 - Physical sciences > F100 - Chemistry²

Divisions:

Faculty of Engineering and Physical Sciences > School of Chemistry³
Faculty of Engineering and Physical Sciences > School of Physics and Astronomy⁴

Related resources:

Location	Type
https://doi.org/10.1002/chem.201700820⁵	Publication
https://eprints.whiterose.ac.uk/114618/⁶	Publication

License:

Creative Commons Attribution 4.0 International (CC BY 4.0)

Date deposited:

11 Apr 2017 15:40

URI:

https://archive.researchdata.leeds.ac.uk/id/eprint/139⁷

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/0000-0001-7491-9034⁸			University of Leeds	https://ror.org/024mrxd33	ror
Burrows, Kay E.	https://orcid.org/0000-0002-5485-6256⁹			University of Leeds	https://ror.org/024mrxd33	ror
McGrath, Sarah E.				University of Leeds	https://ror.org/024mrxd33	ror
Kulmaczewski, Rafał	https://orcid.org/0000-0002-3855-4530¹⁰			University of Leeds	https://ror.org/024mrxd33	ror
Cespedes, Oscar	https://orcid.org/0000-0002-5249-9523¹¹			University of Leeds	https://ror.org/024mrxd33	ror
Barrett, Simon A.				University of Leeds	https://ror.org/024mrxd33	ror

Type of data:

Dataset

Research funders:

EPSRC, Leverhulme Trust, EPSRC, EPSRC

Grant numbers:

EP/K012568/1, RPG-2015-095, EP/K012568/1, EP/K00512X/1

Publication date:

2017

Resource language:

English

Metadata language:

English

Research project title:

Switchable molecular crystals, Exploiting a spin-crossover module, SQUID magnetometer

Publisher:

University of Leeds

Contact email:

m.a.halcrow@leeds.ac.uk¹²

Last Modified:

20 Aug 2024 10:46

Files

Documentation

Compound naming and metadata [39kB]

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Compound naming and metadata [39kB]

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Data

CHN microanalysis [1MB]

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CHN microanalysis [1MB]

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Single crystal X-ray diffraction [8MB]

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Single crystal X-ray diffraction [8MB]

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Magnetic susceptibility [533kB]

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Magnetic susceptibility [533kB]

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Evans method [9MB]

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Evans method [9MB]

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NMR spectra [8MB]

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NMR spectra [8MB]

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X-ray powder diffraction [237kB]

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X-ray powder diffraction [237kB]

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³⁹

1. https://doi.org/10.5518/184
2. https://archive.researchdata.leeds.ac.uk/view/subjects/F100.html
3. https://archive.researchdata.leeds.ac.uk/view/divisions/CHEM/
4. https://archive.researchdata.leeds.ac.uk/view/divisions/SPA/
5. https://doi.org/10.1002/chem.201700820
6. https://eprints.whiterose.ac.uk/114618/
7. https://archive.researchdata.leeds.ac.uk/id/eprint/139
8. https://orcid.org/0000-0001-7491-9034
9. https://orcid.org/0000-0002-5485-6256
10. https://orcid.org/0000-0002-3855-4530
11. https://orcid.org/0000-0002-5249-9523
12. mailto:m.a.halcrow@leeds.ac.uk
13. https://archive.researchdata.leeds.ac.uk/139/1/readme.pdf
14. https://archive.researchdata.leeds.ac.uk/139/1/readme.pdf
15. https://archive.researchdata.leeds.ac.uk/139/1/readme.pdf
16. https://archive.researchdata.leeds.ac.uk/139/1/readme.pdf
17. https://archive.researchdata.leeds.ac.uk/139/2/Microanalysis.zip
18. https://archive.researchdata.leeds.ac.uk/139/2/Microanalysis.zip
19. https://archive.researchdata.leeds.ac.uk/139/2/Microanalysis.zip
20. https://archive.researchdata.leeds.ac.uk/139/2/Microanalysis.zip
21. https://archive.researchdata.leeds.ac.uk/139/3/crystal.zip
22. https://archive.researchdata.leeds.ac.uk/139/3/crystal.zip
23. https://archive.researchdata.leeds.ac.uk/139/3/crystal.zip
24. https://archive.researchdata.leeds.ac.uk/139/3/crystal.zip
25. https://archive.researchdata.leeds.ac.uk/139/4/magnetism.zip
26. https://archive.researchdata.leeds.ac.uk/139/4/magnetism.zip
27. https://archive.researchdata.leeds.ac.uk/139/4/magnetism.zip
28. https://archive.researchdata.leeds.ac.uk/139/4/magnetism.zip
29. https://archive.researchdata.leeds.ac.uk/139/5/Evans.zip
30. https://archive.researchdata.leeds.ac.uk/139/5/Evans.zip
31. https://archive.researchdata.leeds.ac.uk/139/5/Evans.zip
32. https://archive.researchdata.leeds.ac.uk/139/5/Evans.zip
33. https://archive.researchdata.leeds.ac.uk/139/6/NMR.zip
34. https://archive.researchdata.leeds.ac.uk/139/6/NMR.zip
35. https://archive.researchdata.leeds.ac.uk/139/6/NMR.zip
36. https://archive.researchdata.leeds.ac.uk/139/6/NMR.zip
37. https://archive.researchdata.leeds.ac.uk/139/7/XRPD.zip
38. https://archive.researchdata.leeds.ac.uk/139/7/XRPD.zip
39. https://archive.researchdata.leeds.ac.uk/139/7/XRPD.zip
40. https://archive.researchdata.leeds.ac.uk/139/7/XRPD.zip

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