<HashMap><database>biostudies-literature</database><scores/><additional><submitter>Yan H</submitter><funding>Ministry of Defense- Japan</funding><funding>Japan Society for the Promotion of Science</funding><pagination>6842-6847</pagination><full_dataset_link>https://www.ebi.ac.uk/biostudies/studies/S-EPMC7970544</full_dataset_link><repository>biostudies-literature</repository><omics_type>Unknown</omics_type><volume>6(10)</volume><pubmed_abstract>A new ternary chromium disulfide, Ba&lt;sub>9&lt;/sub>Cr&lt;sub>4&lt;/sub>S&lt;sub>19&lt;/sub>, has been grown out of BaCl&lt;sub>2&lt;/sub> molten salt. Single-crystal structure analysis revealed that it crystallizes in the centrosymmetric space group &lt;i>&lt;i>C&lt;/i>&lt;/i> 2/&lt;i>c&lt;/i> with lattice parameters: &lt;i>a&lt;/i> = 12.795(3) Å, &lt;i>b&lt;/i> = 11.3269(2) Å, &lt;i>c&lt;/i> = 23.2057(6) Å, β = 104.041(3)°, and &lt;i>Z&lt;/i> = 4. Ba&lt;sub>9&lt;/sub>Cr&lt;sub>4&lt;/sub>S&lt;sub>19&lt;/sub> comprises four face-sharing Cr-centered octahedra with disulfide ions occupying sites on each terminal face. The resulting Cr&lt;sub>4&lt;/sub>S&lt;sub>15&lt;/sub> tetramer units are isolated by nonmagnetic Ba-centered polyhedra in the &lt;i>ab&lt;/i> plane and barium disulfide (=Ba&lt;sub>4&lt;/sub>(S&lt;sub>2&lt;/sub>)&lt;sub>2&lt;/sub>) layers along the &lt;i>c&lt;/i>-axis. Following the structure analysis, the title compound should be expressed as [Ba&lt;sup>2+&lt;/sup>]&lt;sub>9&lt;/sub>[Cr&lt;sup>3+&lt;/sup>]&lt;sub>4&lt;/sub>[(S&lt;sub>2&lt;/sub>)&lt;sup>2-&lt;/sup>]&lt;sub>4&lt;/sub>[S&lt;sup>2-&lt;/sup>]&lt;sub>11&lt;/sub>, which is also consistent with Cr2p X-ray photoemission spectra showing trivalent states of the Cr atoms. The unique Cr-based zero-dimensional structure with the formation of these disulfide ions can be achieved for the first time in ternary chromium sulfides, which adopt 1-3 dimensional frameworks of Cr-centered polyhedra.</pubmed_abstract><journal>ACS omega</journal><pubmed_title>Flux Crystal Growth, Crystal Structure, and Magnetic Properties of a Ternary Chromium Disulfide Ba&lt;sub>9&lt;/sub>Cr&lt;sub>4&lt;/sub>S&lt;sub>19&lt;/sub> with Unusual Cr&lt;sub>4&lt;/sub>S&lt;sub>15&lt;/sub> Tetramer Units.</pubmed_title><pmcid>PMC7970544</pmcid><funding_grant_id>15H02024</funding_grant_id><funding_grant_id>20H05276</funding_grant_id><funding_grant_id>16H06438</funding_grant_id><funding_grant_id>16H06439</funding_grant_id><funding_grant_id>19H04711</funding_grant_id><funding_grant_id>JPJ004596</funding_grant_id><funding_grant_id>19H02594</funding_grant_id><funding_grant_id>16H06441</funding_grant_id><pubmed_authors>Chikamatsu A</pubmed_authors><pubmed_authors>Hasegawa T</pubmed_authors><pubmed_authors>Tsujimoto Y</pubmed_authors><pubmed_authors>Yamaura K</pubmed_authors><pubmed_authors>Yan H</pubmed_authors><pubmed_authors>Matsushita Y</pubmed_authors></additional><is_claimable>false</is_claimable><name>Flux Crystal Growth, Crystal Structure, and Magnetic Properties of a Ternary Chromium Disulfide Ba&lt;sub>9&lt;/sub>Cr&lt;sub>4&lt;/sub>S&lt;sub>19&lt;/sub> with Unusual Cr&lt;sub>4&lt;/sub>S&lt;sub>15&lt;/sub> Tetramer Units.</name><description>A new ternary chromium disulfide, Ba&lt;sub>9&lt;/sub>Cr&lt;sub>4&lt;/sub>S&lt;sub>19&lt;/sub>, has been grown out of BaCl&lt;sub>2&lt;/sub> molten salt. Single-crystal structure analysis revealed that it crystallizes in the centrosymmetric space group &lt;i>&lt;i>C&lt;/i>&lt;/i> 2/&lt;i>c&lt;/i> with lattice parameters: &lt;i>a&lt;/i> = 12.795(3) Å, &lt;i>b&lt;/i> = 11.3269(2) Å, &lt;i>c&lt;/i> = 23.2057(6) Å, β = 104.041(3)°, and &lt;i>Z&lt;/i> = 4. Ba&lt;sub>9&lt;/sub>Cr&lt;sub>4&lt;/sub>S&lt;sub>19&lt;/sub> comprises four face-sharing Cr-centered octahedra with disulfide ions occupying sites on each terminal face. The resulting Cr&lt;sub>4&lt;/sub>S&lt;sub>15&lt;/sub> tetramer units are isolated by nonmagnetic Ba-centered polyhedra in the &lt;i>ab&lt;/i> plane and barium disulfide (=Ba&lt;sub>4&lt;/sub>(S&lt;sub>2&lt;/sub>)&lt;sub>2&lt;/sub>) layers along the &lt;i>c&lt;/i>-axis. Following the structure analysis, the title compound should be expressed as [Ba&lt;sup>2+&lt;/sup>]&lt;sub>9&lt;/sub>[Cr&lt;sup>3+&lt;/sup>]&lt;sub>4&lt;/sub>[(S&lt;sub>2&lt;/sub>)&lt;sup>2-&lt;/sup>]&lt;sub>4&lt;/sub>[S&lt;sup>2-&lt;/sup>]&lt;sub>11&lt;/sub>, which is also consistent with Cr2p X-ray photoemission spectra showing trivalent states of the Cr atoms. The unique Cr-based zero-dimensional structure with the formation of these disulfide ions can be achieved for the first time in ternary chromium sulfides, which adopt 1-3 dimensional frameworks of Cr-centered polyhedra.</description><dates><release>2021-01-01T00:00:00Z</release><publication>2021 Mar</publication><modification>2025-04-20T02:27:40.563Z</modification><creation>2025-04-20T02:27:40.563Z</creation></dates><accession>S-EPMC7970544</accession><cross_references><pubmed>33748598</pubmed><doi>10.1021/acsomega.0c06017</doi></cross_references></HashMap>