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dc.contributor.authorKarhu, Aino J.
dc.contributor.authorJämsä, Juho
dc.contributor.authorRautiainen, J. Mikko
dc.contributor.authorOilunkaniemi, Raija
dc.contributor.authorChivers, Tristram
dc.contributor.authorLaitinen, Risto S.
dc.date.accessioned2018-01-17T13:21:05Z
dc.date.available2018-03-16T22:45:12Z
dc.date.issued2017
dc.identifier.citationKarhu, A. J., Jämsä, J., Rautiainen, J. M., Oilunkaniemi, R., Chivers, T., & Laitinen, R. S. (2017). A Selenium-Nitrogen Chain with Selenium in Different Oxidation States. <i>Zeitschrift für anorganische und allgemeine Chemie</i>, <i>643</i>(7), 495-500. <a href="https://doi.org/10.1002/zaac.201700031" target="_blank">https://doi.org/10.1002/zaac.201700031</a>
dc.identifier.otherCONVID_26913809
dc.identifier.otherTUTKAID_73293
dc.identifier.urihttps://jyx.jyu.fi/handle/123456789/56771
dc.description.abstractThe reaction of tBuNH2 with a mixture of SeCl2 and SeOCl2 in a 6:2:1 molar ratio produces the novel selenium-nitrogen chain ClSeN(tBu)Se(O)Cl (4), in which the selenium atoms are in two different oxidation states, SeII and SeIV. The crystal structure of 4 is compared with that of the related SeII/SeII system ClSeN(tBu)SeCl (1) and differences are attributed to hyperconjugative effects. The energetics of the formation of 4 via two different routes are elucidated by PBE0/def2-TZVPP calculations.en
dc.language.isoeng
dc.publisherWiley-VCH-Verlag
dc.relation.ispartofseriesZeitschrift für anorganische und allgemeine Chemie
dc.subject.otherselenium-nitrogen chains
dc.subject.otheroxidation states
dc.titleA Selenium-Nitrogen Chain with Selenium in Different Oxidation States
dc.typearticle
dc.identifier.urnURN:NBN:fi:jyu-201801121171
dc.contributor.laitosKemian laitosfi
dc.contributor.laitosDepartment of Chemistryen
dc.contributor.oppiaineEpäorgaaninen ja analyyttinen kemiafi
dc.contributor.oppiaineInorganic and Analytical Chemistryen
dc.type.urihttp://purl.org/eprint/type/JournalArticle
dc.date.updated2018-01-12T13:15:13Z
dc.type.coarhttp://purl.org/coar/resource_type/c_2df8fbb1
dc.description.reviewstatuspeerReviewed
dc.format.pagerange495-500
dc.relation.issn0044-2313
dc.relation.numberinseries7
dc.relation.volume643
dc.type.versionacceptedVersion
dc.rights.copyright© Wiley-VCH-Verlag, 2017. This is a final draft version of an article whose final and definitive form has been published by Wiley-VCH-Verlag. Published in this repository with the kind permission of the publisher.
dc.rights.accesslevelopenAccessfi
dc.subject.ysokemialliset sidokset
jyx.subject.urihttp://www.yso.fi/onto/yso/p10130
dc.relation.doi10.1002/zaac.201700031
jyx.fundinginformationFinancial support from Academy of Finland [grant numbers 134548 (R. S. L.) and 253400 (J. M. R.)], Finnish Cultural Foundation (A. J. K.), Magnus Ehrnrooth Foundation (A. J. K.), Oulu University Scholarship Foundation (A. J. K.), and the Natural Sciences and Engineering Research Council (NSERC, Canada) (T. C.) is gratefully acknowledged. We are also grateful to Finnish CSC-IT Center for Science Ltd for their provision of computational resources.
dc.type.okmA1


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