Influence of Solvent in Crystal Engineering: A Significant Change to the Order–Disorder Transition in Ferrocene
We present the structure of a novel solvate adduct formed by dissolving ferrocene, FeCp2, in hexafluorobenzene, C6F6. This adduct demonstrates the remarkably strong interactions between the five-membered aromatic rings of FeCp2 and the six-membered aromatic ring of C6F6. These molecular interactions...
Gespeichert in:
| Veröffentlicht in: | Journal of the American Chemical Society 2020-01, Vol.142 (4), p.1731-1734 |
|---|---|
| Hauptverfasser: | , , |
| Format: | Artikel |
| Sprache: | eng |
| Online-Zugang: | Volltext |
| Tags: |
Tag hinzufügen
Keine Tags, Fügen Sie den ersten Tag hinzu!
|
| container_end_page | 1734 |
|---|---|
| container_issue | 4 |
| container_start_page | 1731 |
| container_title | Journal of the American Chemical Society |
| container_volume | 142 |
| creator | Bear, Joseph C Cockcroft, Jeremy K Williams, Jeffrey H |
| description | We present the structure of a novel solvate adduct formed by dissolving ferrocene, FeCp2, in hexafluorobenzene, C6F6. This adduct demonstrates the remarkably strong interactions between the five-membered aromatic rings of FeCp2 and the six-membered aromatic ring of C6F6. These molecular interactions are sufficiently strong and anisotropic to change the temperature of the order–disorder transition of the ferrocene molecule from below ca. 164 K to RT. No solvate adduct could be formed between benzene and FeCp2. These observations will be of particular relevance to the crystal engineering community, whose goal is the design of solids with bespoke properties. |
| doi_str_mv | 10.1021/jacs.9b11895 |
| format | Article |
| fullrecord | <record><control><sourceid>proquest_cross</sourceid><recordid>TN_cdi_proquest_miscellaneous_2338075691</recordid><sourceformat>XML</sourceformat><sourcesystem>PC</sourcesystem><sourcerecordid>2338075691</sourcerecordid><originalsourceid>FETCH-LOGICAL-a362t-359239e78331f2db573fb6c0f88110ff7844c65608671bccc921d7dcb4edd41a3</originalsourceid><addsrcrecordid>eNptkL9u2zAQh4miReM62ToHHDtELo_UHzJb4MRNgAAeks4CRR1tGjKZkFKAbHmHvmGfpBLsNkunuwO--x3uI-QrsAUwDt932qSFagCkKj6QGRScZQXw8iOZMcZ4VslSnJAvKe3GMecSPpMTAYpXSrEZeb7zthvQG6TB0ofQvaDvqfN0GV9Trzt64zfOI0bnN5f0ij64jXfWGT1Sy632G6R9oP0W6Tq2GH-__bp2KUwtfYzaJ9e74Ke8FcYYDHo8JZ-s7hKeHeuc_FzdPC5vs_v1j7vl1X2mRcn7TBSKC4WVFAIsb5uiErYpDbNSAjBrK5nnpixKJssKGmOM4tBWrWlybNsctJiTb4fcpxieB0x9vXfJYNdpj2FINRdCsqooFYzoxQE1MaQU0dZP0e11fK2B1ZPkepJcHyWP-PkxeWj22P6D_1p9Pz1t7cIQ_fjo_7P-AJtPhqs</addsrcrecordid><sourcetype>Aggregation Database</sourcetype><iscdi>true</iscdi><recordtype>article</recordtype><pqid>2338075691</pqid></control><display><type>article</type><title>Influence of Solvent in Crystal Engineering: A Significant Change to the Order–Disorder Transition in Ferrocene</title><source>American Chemical Society Journals</source><creator>Bear, Joseph C ; Cockcroft, Jeremy K ; Williams, Jeffrey H</creator><creatorcontrib>Bear, Joseph C ; Cockcroft, Jeremy K ; Williams, Jeffrey H</creatorcontrib><description>We present the structure of a novel solvate adduct formed by dissolving ferrocene, FeCp2, in hexafluorobenzene, C6F6. This adduct demonstrates the remarkably strong interactions between the five-membered aromatic rings of FeCp2 and the six-membered aromatic ring of C6F6. These molecular interactions are sufficiently strong and anisotropic to change the temperature of the order–disorder transition of the ferrocene molecule from below ca. 164 K to RT. No solvate adduct could be formed between benzene and FeCp2. These observations will be of particular relevance to the crystal engineering community, whose goal is the design of solids with bespoke properties.</description><identifier>ISSN: 0002-7863</identifier><identifier>EISSN: 1520-5126</identifier><identifier>DOI: 10.1021/jacs.9b11895</identifier><identifier>PMID: 31927990</identifier><language>eng</language><publisher>United States: American Chemical Society</publisher><ispartof>Journal of the American Chemical Society, 2020-01, Vol.142 (4), p.1731-1734</ispartof><lds50>peer_reviewed</lds50><oa>free_for_read</oa><woscitedreferencessubscribed>false</woscitedreferencessubscribed><citedby>FETCH-LOGICAL-a362t-359239e78331f2db573fb6c0f88110ff7844c65608671bccc921d7dcb4edd41a3</citedby><cites>FETCH-LOGICAL-a362t-359239e78331f2db573fb6c0f88110ff7844c65608671bccc921d7dcb4edd41a3</cites><orcidid>0000-0002-4954-651X ; 0000-0001-6504-4723</orcidid></display><links><openurl>$$Topenurl_article</openurl><openurlfulltext>$$Topenurlfull_article</openurlfulltext><thumbnail>$$Tsyndetics_thumb_exl</thumbnail><linktopdf>$$Uhttps://pubs.acs.org/doi/pdf/10.1021/jacs.9b11895$$EPDF$$P50$$Gacs$$H</linktopdf><linktohtml>$$Uhttps://pubs.acs.org/doi/10.1021/jacs.9b11895$$EHTML$$P50$$Gacs$$H</linktohtml><link.rule.ids>314,776,780,2752,27053,27901,27902,56713,56763</link.rule.ids><backlink>$$Uhttps://www.ncbi.nlm.nih.gov/pubmed/31927990$$D View this record in MEDLINE/PubMed$$Hfree_for_read</backlink></links><search><creatorcontrib>Bear, Joseph C</creatorcontrib><creatorcontrib>Cockcroft, Jeremy K</creatorcontrib><creatorcontrib>Williams, Jeffrey H</creatorcontrib><title>Influence of Solvent in Crystal Engineering: A Significant Change to the Order–Disorder Transition in Ferrocene</title><title>Journal of the American Chemical Society</title><addtitle>J. Am. Chem. Soc</addtitle><description>We present the structure of a novel solvate adduct formed by dissolving ferrocene, FeCp2, in hexafluorobenzene, C6F6. This adduct demonstrates the remarkably strong interactions between the five-membered aromatic rings of FeCp2 and the six-membered aromatic ring of C6F6. These molecular interactions are sufficiently strong and anisotropic to change the temperature of the order–disorder transition of the ferrocene molecule from below ca. 164 K to RT. No solvate adduct could be formed between benzene and FeCp2. These observations will be of particular relevance to the crystal engineering community, whose goal is the design of solids with bespoke properties.</description><issn>0002-7863</issn><issn>1520-5126</issn><fulltext>true</fulltext><rsrctype>article</rsrctype><creationdate>2020</creationdate><recordtype>article</recordtype><recordid>eNptkL9u2zAQh4miReM62ToHHDtELo_UHzJb4MRNgAAeks4CRR1tGjKZkFKAbHmHvmGfpBLsNkunuwO--x3uI-QrsAUwDt932qSFagCkKj6QGRScZQXw8iOZMcZ4VslSnJAvKe3GMecSPpMTAYpXSrEZeb7zthvQG6TB0ofQvaDvqfN0GV9Trzt64zfOI0bnN5f0ij64jXfWGT1Sy632G6R9oP0W6Tq2GH-__bp2KUwtfYzaJ9e74Ke8FcYYDHo8JZ-s7hKeHeuc_FzdPC5vs_v1j7vl1X2mRcn7TBSKC4WVFAIsb5uiErYpDbNSAjBrK5nnpixKJssKGmOM4tBWrWlybNsctJiTb4fcpxieB0x9vXfJYNdpj2FINRdCsqooFYzoxQE1MaQU0dZP0e11fK2B1ZPkepJcHyWP-PkxeWj22P6D_1p9Pz1t7cIQ_fjo_7P-AJtPhqs</recordid><startdate>20200129</startdate><enddate>20200129</enddate><creator>Bear, Joseph C</creator><creator>Cockcroft, Jeremy K</creator><creator>Williams, Jeffrey H</creator><general>American Chemical Society</general><scope>NPM</scope><scope>AAYXX</scope><scope>CITATION</scope><scope>7X8</scope><orcidid>https://orcid.org/0000-0002-4954-651X</orcidid><orcidid>https://orcid.org/0000-0001-6504-4723</orcidid></search><sort><creationdate>20200129</creationdate><title>Influence of Solvent in Crystal Engineering: A Significant Change to the Order–Disorder Transition in Ferrocene</title><author>Bear, Joseph C ; Cockcroft, Jeremy K ; Williams, Jeffrey H</author></sort><facets><frbrtype>5</frbrtype><frbrgroupid>cdi_FETCH-LOGICAL-a362t-359239e78331f2db573fb6c0f88110ff7844c65608671bccc921d7dcb4edd41a3</frbrgroupid><rsrctype>articles</rsrctype><prefilter>articles</prefilter><language>eng</language><creationdate>2020</creationdate><toplevel>peer_reviewed</toplevel><toplevel>online_resources</toplevel><creatorcontrib>Bear, Joseph C</creatorcontrib><creatorcontrib>Cockcroft, Jeremy K</creatorcontrib><creatorcontrib>Williams, Jeffrey H</creatorcontrib><collection>PubMed</collection><collection>CrossRef</collection><collection>MEDLINE - Academic</collection><jtitle>Journal of the American Chemical Society</jtitle></facets><delivery><delcategory>Remote Search Resource</delcategory><fulltext>fulltext</fulltext></delivery><addata><au>Bear, Joseph C</au><au>Cockcroft, Jeremy K</au><au>Williams, Jeffrey H</au><format>journal</format><genre>article</genre><ristype>JOUR</ristype><atitle>Influence of Solvent in Crystal Engineering: A Significant Change to the Order–Disorder Transition in Ferrocene</atitle><jtitle>Journal of the American Chemical Society</jtitle><addtitle>J. Am. Chem. Soc</addtitle><date>2020-01-29</date><risdate>2020</risdate><volume>142</volume><issue>4</issue><spage>1731</spage><epage>1734</epage><pages>1731-1734</pages><issn>0002-7863</issn><eissn>1520-5126</eissn><abstract>We present the structure of a novel solvate adduct formed by dissolving ferrocene, FeCp2, in hexafluorobenzene, C6F6. This adduct demonstrates the remarkably strong interactions between the five-membered aromatic rings of FeCp2 and the six-membered aromatic ring of C6F6. These molecular interactions are sufficiently strong and anisotropic to change the temperature of the order–disorder transition of the ferrocene molecule from below ca. 164 K to RT. No solvate adduct could be formed between benzene and FeCp2. These observations will be of particular relevance to the crystal engineering community, whose goal is the design of solids with bespoke properties.</abstract><cop>United States</cop><pub>American Chemical Society</pub><pmid>31927990</pmid><doi>10.1021/jacs.9b11895</doi><tpages>4</tpages><orcidid>https://orcid.org/0000-0002-4954-651X</orcidid><orcidid>https://orcid.org/0000-0001-6504-4723</orcidid><oa>free_for_read</oa></addata></record> |
| fulltext | fulltext |
| identifier | ISSN: 0002-7863 |
| ispartof | Journal of the American Chemical Society, 2020-01, Vol.142 (4), p.1731-1734 |
| issn | 0002-7863 1520-5126 |
| language | eng |
| recordid | cdi_proquest_miscellaneous_2338075691 |
| source | American Chemical Society Journals |
| title | Influence of Solvent in Crystal Engineering: A Significant Change to the Order–Disorder Transition in Ferrocene |
| url | https://sfx.bib-bvb.de/sfx_tum?ctx_ver=Z39.88-2004&ctx_enc=info:ofi/enc:UTF-8&ctx_tim=2025-02-02T23%3A33%3A44IST&url_ver=Z39.88-2004&url_ctx_fmt=infofi/fmt:kev:mtx:ctx&rfr_id=info:sid/primo.exlibrisgroup.com:primo3-Article-proquest_cross&rft_val_fmt=info:ofi/fmt:kev:mtx:journal&rft.genre=article&rft.atitle=Influence%20of%20Solvent%20in%20Crystal%20Engineering:%20A%20Significant%20Change%20to%20the%20Order%E2%80%93Disorder%20Transition%20in%20Ferrocene&rft.jtitle=Journal%20of%20the%20American%20Chemical%20Society&rft.au=Bear,%20Joseph%20C&rft.date=2020-01-29&rft.volume=142&rft.issue=4&rft.spage=1731&rft.epage=1734&rft.pages=1731-1734&rft.issn=0002-7863&rft.eissn=1520-5126&rft_id=info:doi/10.1021/jacs.9b11895&rft_dat=%3Cproquest_cross%3E2338075691%3C/proquest_cross%3E%3Curl%3E%3C/url%3E&disable_directlink=true&sfx.directlink=off&sfx.report_link=0&rft_id=info:oai/&rft_pqid=2338075691&rft_id=info:pmid/31927990&rfr_iscdi=true |