A Comparative Study on the Thermodynamics of Halogen Bonding of Group 10 Pincer Fluoride Complexes
dc.bibliographicCitation.firstPage | 3571 | eng |
dc.bibliographicCitation.issue | 16 | eng |
dc.bibliographicCitation.lastPage | 3577 | eng |
dc.bibliographicCitation.volume | 26 | eng |
dc.contributor.author | Joksch, Markus | |
dc.contributor.author | Agarwala, Hemlata | |
dc.contributor.author | Ferro, Monica | |
dc.contributor.author | Michalik, Dirk | |
dc.contributor.author | Spannenberg, Anke | |
dc.contributor.author | Beweries, Torsten | |
dc.date.accessioned | 2021-09-15T13:23:32Z | |
dc.date.available | 2021-09-15T13:23:32Z | |
dc.date.issued | 2019 | |
dc.description.abstract | The thermodynamics of halogen bonding of a series of isostructural Group 10 metal pincer fluoride complexes of the type [(3,5-R2-tBuPOCOPtBu)MF] (3,5-R2-tBuPOCOPtBu=κ3-C6HR2-2,6-(OPtBu2)2 with R=H, tBu, COOMe; M=Ni, Pd, Pt) and iodopentafluorobenzene was investigated. Based on NMR experiments at different temperatures, all complexes 1-tBu (R=tBu, M=Ni), 2-H (R=H, M=Pd), 2-tBu (R=tBu, M=Pd), 2-COOMe (R=COOMe, M=Pd) and 3-tBu (R=tBu, M=Pt) form strong halogen bonds with Pd complexes showing significantly stronger binding to iodopentafluorobenzene. Structural and computational analysis of a model adduct of complex 2-tBu with 1,4-diiodotetrafluorobenzene as well as of structures of iodopentafluorobenzene in toluene solution shows that formation of a type I contact occurs. © 2019 The Authors. Published by Wiley-VCH Verlag GmbH & Co. KGaA. | eng |
dc.description.version | publishedVersion | eng |
dc.identifier.uri | https://oa.tib.eu/renate/handle/123456789/6818 | |
dc.identifier.uri | https://doi.org/10.34657/5865 | |
dc.language.iso | eng | eng |
dc.publisher | Weinheim : Wiley-VCH | eng |
dc.relation.doi | https://doi.org/10.1002/chem.201904863 | |
dc.relation.essn | 1521-3765 | |
dc.relation.ispartofseries | Chemistry - a European journal 26 (2020), Nr. 16 | eng |
dc.relation.issn | 0947-6539 | |
dc.rights.license | CC BY 4.0 Unported | eng |
dc.rights.uri | https://creativecommons.org/licenses/by/4.0/ | eng |
dc.subject | halogen bonding | eng |
dc.subject.ddc | 540 | eng |
dc.subject.ddc | 660 | eng |
dc.title | A Comparative Study on the Thermodynamics of Halogen Bonding of Group 10 Pincer Fluoride Complexes | eng |
dc.type | article | eng |
dc.type | Text | eng |
dcterms.bibliographicCitation.journalTitle | Chemistry - a European journal | eng |
tib.accessRights | openAccess | eng |
wgl.contributor | LIKAT | eng |
wgl.subject | Chemie | eng |
wgl.type | Zeitschriftenartikel | eng |
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