dc.contributor.author | Limberg, Niklas | |
dc.contributor.author | Rautiainen, J. Mikko | |
dc.contributor.author | Lundell, Jan | |
dc.contributor.author | Riedel, Sebastian | |
dc.contributor.author | Rissanen, Kari | |
dc.contributor.author | Puttreddy, Rakesh | |
dc.date.accessioned | 2024-11-12T10:53:16Z | |
dc.date.available | 2024-11-12T10:53:16Z | |
dc.date.issued | 2024 | |
dc.identifier.citation | Limberg, N., Rautiainen, J. M., Lundell, J., Riedel, S., Rissanen, K., & Puttreddy, R. (2024). Dichlorine–pyridine <i>N</i>-oxide halogen-bonded complexes. <i>Chemical Science</i>, <i>Early online</i>. <a href="https://doi.org/10.1039/d4sc06270a" target="_blank">https://doi.org/10.1039/d4sc06270a</a> | |
dc.identifier.other | CONVID_243807699 | |
dc.identifier.uri | https://jyx.jyu.fi/handle/123456789/98285 | |
dc.description.abstract | A new Cl–Cl···−O–N+ halogen-bonded paradigm has been demonstrated, using dichlorine as a halogen bond (XB) donor and N-oxide as an XB acceptor. Their crystalline complexes were formed during the warm-up process from −196 °C to −80 °C for X-ray diffraction analysis. They exhibit high instability in the crystalline state, even at these low temperatures, leading to rapid decomposition and the formation of Cl⋯H–O–N hydrogen-bonded complexes. The normalized XB interaction ratio (RXB) of Cl⋯O interactions in the solid-state demonstrates affinity comparable to traditional I⋯O interactions observed in I–I···−O–N+ halogen-bonded systems. The Cl–Cl⋯O XB angles vary from 172° to 177°, manifesting the structure-guiding influence of the electronegative chlorine atom's σ-hole on these XB interactions. | en |
dc.format.mimetype | application/pdf | |
dc.language.iso | eng | |
dc.publisher | Royal Society of Chemistry | |
dc.relation.ispartofseries | Chemical Science | |
dc.rights | CC BY 4.0 | |
dc.title | Dichlorine–pyridine pyridine N-oxide halogen-bonded
complexes | |
dc.type | article | |
dc.identifier.urn | URN:NBN:fi:jyu-202411127131 | |
dc.contributor.laitos | Kemian laitos | fi |
dc.contributor.laitos | Department of Chemistry | en |
dc.type.uri | http://purl.org/eprint/type/JournalArticle | |
dc.type.coar | http://purl.org/coar/resource_type/c_2df8fbb1 | |
dc.description.reviewstatus | peerReviewed | |
dc.relation.issn | 2041-6520 | |
dc.relation.volume | Early online | |
dc.type.version | publishedVersion | |
dc.rights.copyright | © 2024 The Author(s). Published by the Royal Society of Chemistry | |
dc.rights.accesslevel | openAccess | fi |
dc.relation.grantnumber | 351121 | |
dc.relation.grantnumber | 338733 | |
dc.relation.grantnumber | 332023 | |
dc.subject.yso | kemialliset reaktiot | |
dc.subject.yso | halogeenit | |
dc.format.content | fulltext | |
jyx.subject.uri | http://www.yso.fi/onto/yso/p3658 | |
jyx.subject.uri | http://www.yso.fi/onto/yso/p4164 | |
dc.rights.url | https://creativecommons.org/licenses/by/4.0/ | |
dc.relation.doi | 10.1039/d4sc06270a | |
dc.relation.funder | Research Council of Finland | en |
dc.relation.funder | Research Council of Finland | en |
dc.relation.funder | Research Council of Finland | en |
dc.relation.funder | Suomen Akatemia | fi |
dc.relation.funder | Suomen Akatemia | fi |
dc.relation.funder | Suomen Akatemia | fi |
jyx.fundingprogram | Academy Project, AoF | en |
jyx.fundingprogram | Academy Project, AoF | en |
jyx.fundingprogram | Academy Project, AoF | en |
jyx.fundingprogram | Akatemiahanke, SA | fi |
jyx.fundingprogram | Akatemiahanke, SA | fi |
jyx.fundingprogram | Akatemiahanke, SA | fi |
jyx.fundinginformation | The authors gratefully acknowledge financial support from the Research Council of Finland [grant number 351121 (KR), 332023 (JL), and 338733 (JMR)]. The work was also funded by the European Research Council (ERC) Project HighPotOx (ID: 818862) (SR). We gratefully acknowledge the assistance of the Core Facility BioSupraMol at FU Berlin which is supported by the DFG. | |
dc.type.okm | A1 | |