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Single crystal X-ray structural features of aromatic compounds having a pentafluorosulfuranyl (SF5) functional group

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dc.contributor.authorDu, Junyi
dc.contributor.authorHua, Guoxiong
dc.contributor.authorBeier, Petr
dc.contributor.authorSlawin, Alexandra M. Z.
dc.contributor.authorWoollins, J. Derek
dc.date.accessioned2017-10-04T23:32:24Z
dc.date.available2017-10-04T23:32:24Z
dc.date.issued2017-06
dc.identifier.citationDu , J , Hua , G , Beier , P , Slawin , A M Z & Woollins , J D 2017 , ' Single crystal X-ray structural features of aromatic compounds having a pentafluorosulfuranyl (SF 5 ) functional group ' , Structural Chemistry , vol. 28 , no. 3 , pp. 723-733 . https://doi.org/10.1007/s11224-016-0854-2en
dc.identifier.issn1040-0400
dc.identifier.otherPURE: 245780312
dc.identifier.otherPURE UUID: 1833af76-d54b-4ee8-9908-08b85ee9092a
dc.identifier.otherScopus: 84990856298
dc.identifier.otherORCID: /0000-0002-9527-6418/work/56861648
dc.identifier.otherORCID: /0000-0002-1498-9652/work/31779156
dc.identifier.otherWOS: 000400574100018
dc.identifier.urihttp://hdl.handle.net/10023/11803
dc.descriptionThe authors are grateful to the University of St Andrews for financial support.en
dc.description.abstractNine pentafluorosulfuranyl (SF5)-containing aromatic compounds have been characterized crystallographically. The SF5 group has an umbrella geometry, and the sulfur atom in the SF5 group is in an approximately octahedral coordination environment. All S-F bond lengths [1.572(3) to 1.618(3) Å] are very similar and the C-S-Fax bond angles [178.94(14) to 180°] are very close to each other. The angle of two adjacent Feq is approximate to 90°. The intramolecular and intermolecular interactions such as Caryl-H···Feq, Caryl-H···O/N/F/Cl interactions, and π-stacking interactions play a very important role in their three-dimension packing frameworks.
dc.format.extent11
dc.language.isoeng
dc.relation.ispartofStructural Chemistryen
dc.rights© Springer Science+Business Media New York 2016. This work is made available online in accordance with the publisher’s policies. This is the author created, accepted version manuscript following peer review and may differ slightly from the final published version. The final published version of this work is available at: https://dx.doi.org/10.1007/s11224-016-0854-2en
dc.subjectPentafluorosulfuranyl (SF5) groupen
dc.subjectAromatic compoundsen
dc.subjectSingle crystal X-ray structureen
dc.subjectIntramolecular interactionsen
dc.subjectIntermolecular interactionsen
dc.subjectQD Chemistryen
dc.subjectNDASen
dc.subject.lccQDen
dc.titleSingle crystal X-ray structural features of aromatic compounds having a pentafluorosulfuranyl (SF5) functional groupen
dc.typeJournal articleen
dc.description.versionPostprinten
dc.description.versionPostprinten
dc.contributor.institutionUniversity of St Andrews. School of Chemistryen
dc.contributor.institutionUniversity of St Andrews. EaSTCHEMen
dc.contributor.institutionUniversity of St Andrews. Office of the Principalen
dc.identifier.doihttps://doi.org/10.1007/s11224-016-0854-2
dc.description.statusPeer revieweden
dc.date.embargoedUntil2017-10-04
dc.identifier.urlhttp://link.springer.com/article/10.1007%2Fs11224-016-0854-2#SupplementaryMaterialen


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