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dc.contributor.authorMain, Russell M.
dc.contributor.authorVornholt, Simon M.
dc.contributor.authorRice, Cameron M.
dc.contributor.authorElliott, Caroline
dc.contributor.authorRussell, Samantha E.
dc.contributor.authorKerr, Peter
dc.contributor.authorWarren, Mark R.
dc.contributor.authorMorris, Russell E.
dc.date.accessioned2023-03-08T12:30:07Z
dc.date.available2023-03-08T12:30:07Z
dc.date.issued2023-03-01
dc.identifier.citationMain , R M , Vornholt , S M , Rice , C M , Elliott , C , Russell , S E , Kerr , P , Warren , M R & Morris , R E 2023 , ' In situ single-crystal synchrotron X-ray diffraction studies of biologically active gases in metal-organic frameworks ' , Communications Chemistry , vol. 6 , 44 . https://doi.org/10.1038/s42004-023-00845-1en
dc.identifier.issn2399-3669
dc.identifier.otherPURE: 283534194
dc.identifier.otherPURE UUID: 01427b42-c14b-4889-8c11-89a0ba3c712d
dc.identifier.otherORCID: /0000-0001-7809-0315/work/130660020
dc.identifier.otherScopus: 85149494140
dc.identifier.urihttps://hdl.handle.net/10023/27127
dc.descriptionFunding: The authors are also grateful for financial assistance from the ERC under advanced grant 787073, the EPSRC for a studentship (EP/N509759/1) and the CRITICAT Centre for Doctoral Training (EP/L016419/1).en
dc.description.abstractMetal-organic frameworks (MOFs) are well known for their ability to adsorb various gases. The use of MOFs for the storage and release of biologically active gases, particularly nitric oxide (NO) and carbon monoxide (CO), has been a subject of interest. To elucidate the binding mechanisms and geometry of these gases, an in situ single crystal X-ray diffraction (scXRD) study using synchrotron radiation at Diamond Light Source has been performed on a set of MOFs that display promising gas adsorption properties. NO and CO, were introduced into activated Ni-CPO-27 and the related Co-4,6-dihydroxyisophthalate (Co-4,6-dhip). Both MOFs show strong binding affinity towards CO and NO, however CO suffers more from competitive co-adsorption of water. Additionally, we show that morphology can play an important role in the ease of dehydration for these two systems.
dc.format.extent7
dc.language.isoeng
dc.relation.ispartofCommunications Chemistryen
dc.rightsCopyright © The Author(s) 2023. Open Access. This article is licensed under a Creative Commons Attribution 4.0 International License, which permits use, sharing, adaptation, distribution and reproduction in any medium or format, as long as you give appropriate credit to the original author(s) and the source, provide a link to the Creative Commons license, and indicate if changes were made. The images or other third party material in this article are included in the article’s Creative Commons license, unless indicated otherwise in a credit line to the material. If material is not included in the article’s Creative Commons license and your intended use is not permitted by statutory regulation or exceeds the permitted use, you will need to obtain permission directly from the copyright holder. To view a copy of this license, visit http://creativecommons.org/licenses/by/4.0/.en
dc.subjectMetal-organic frameworken
dc.subjectMOF-74en
dc.subjectCPO-27en
dc.subjectModulation chemistryen
dc.subjectNOen
dc.subjectCOen
dc.subjectscXRDen
dc.subjectGas adsorptionen
dc.subjectSingle crystal transformationen
dc.subjectQD Chemistryen
dc.subjectDASen
dc.subjectMCCen
dc.subject.lccQDen
dc.titleIn situ single-crystal synchrotron X-ray diffraction studies of biologically active gases in metal-organic frameworksen
dc.typeJournal articleen
dc.contributor.sponsorEuropean Research Councilen
dc.contributor.sponsorEPSRCen
dc.description.versionPublisher PDFen
dc.contributor.institutionUniversity of St Andrews. School of Chemistryen
dc.contributor.institutionUniversity of St Andrews. EaSTCHEMen
dc.identifier.doihttps://doi.org/10.1038/s42004-023-00845-1
dc.description.statusPeer revieweden
dc.identifier.grantnumber787073en
dc.identifier.grantnumberEP/L016419/1en


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