{"id":{"repo_id":"etsu","oai_identifier":"oai:dc.etsu.edu:etd-2343"},"canonical_url":"https://search.dev.ndltd.org/etd/etsu/oai:dc.etsu.edu:etd-2343","repository":{"repo_id":"etsu","name":"East Tennessee State University","base_url":"https://dc.etsu.edu/do/oai/"},"display":{"title":"X-ray crystal structures of: [Rh2(N-{2,4,6-CH3}C6H2)COCH3)4]•2NCC6H4 AND Ba1.5[Fe(C10H13N2O7)][Co(CN)6]•9H2O; two crystallographic challenges","abstract":"<p>The novel compound, [Rh<sub>2</sub>(N-{2,4,6-CH<sub>3</sub>}C<sub>6</sub>H<sub>2</sub>)COCH<sub>3</sub>)<sub>4</sub>] was synthesized. Crystal structures of [Rh<sub>2</sub>(N-{2,4,6-CH<sub>3</sub>}C<sub>6</sub>H<sub>2</sub>)COCH<sub>3</sub>)<sub>4</sub>]·2NCC<sub>6</sub>H<sub>5</sub> and Ba<sub>1.5</sub>[Fe(C<sub>10</sub>H<sub>13</sub>N<sub>2</sub>O<sub>7</sub>)][Co(CN)<sub>6</sub>]·9H<sub>2</sub>O were determined employing a Rigaku Mercury375R/M CCD (XtaLAB mini) diffractometer with graphite monochromated Mo-Kα radiation. For [Rh<sub>2</sub>(N-{2,4,6-CH<sub>3</sub>}C<sub>6</sub>H<sub>2</sub>)COCH<sub>3</sub>)<sub>4</sub>]·2NCC<sub>6</sub>H<sub>5</sub>, the space group was P-421c(#114) with unit cell dimensions: a =11.0169(14)Å, c =21.499(3)Å, V = 2609.4(6)Å<sup>3</sup>. Each rhodium had approximately octahedral coordination and was bound to another rhodium atom, two nitrogens (<em>trans</em> to each other), two oxygens (<em>trans</em> to each other), and one benzonitrile nitrogen (<em>trans</em> to rhodium). For Ba<sub>1.5</sub>[Fe(C<sub>10</sub>H<sub>13</sub>N<sub>2</sub>O<sub>7</sub>)][Co(CN)<sub>6</sub>]·9H<sub>2</sub>O the space group was: P-1(#2) with unit cell dimensions: a=13.634Å, b=13.768Å, c=17.254Å and α=84.795°, β=87.863°, γ=78.908°, V=3164.5Å<sup>3</sup>. The iron atom (nearly octahedral) was coordinated to one chelating ligand (derived from ethylenediaminetetraacetic acid) and the nitrogen of a cyanide ligand. The carbon of the cyanide ligand was bound to cobalt (octahedral). Thus, the cyanide ligand serves as a bridge between the two metals.</p>","abstract_html":"&lt;p&gt;The novel compound, [Rh&lt;sub&gt;2&lt;/sub&gt;(N-{2,4,6-CH&lt;sub&gt;3&lt;/sub&gt;}C&lt;sub&gt;6&lt;/sub&gt;H&lt;sub&gt;2&lt;/sub&gt;)COCH&lt;sub&gt;3&lt;/sub&gt;)&lt;sub&gt;4&lt;/sub&gt;] was synthesized. Crystal structures of [Rh&lt;sub&gt;2&lt;/sub&gt;(N-{2,4,6-CH&lt;sub&gt;3&lt;/sub&gt;}C&lt;sub&gt;6&lt;/sub&gt;H&lt;sub&gt;2&lt;/sub&gt;)COCH&lt;sub&gt;3&lt;/sub&gt;)&lt;sub&gt;4&lt;/sub&gt;]·2NCC&lt;sub&gt;6&lt;/sub&gt;H&lt;sub&gt;5&lt;/sub&gt; and Ba&lt;sub&gt;1.5&lt;/sub&gt;[Fe(C&lt;sub&gt;10&lt;/sub&gt;H&lt;sub&gt;13&lt;/sub&gt;N&lt;sub&gt;2&lt;/sub&gt;O&lt;sub&gt;7&lt;/sub&gt;)][Co(CN)&lt;sub&gt;6&lt;/sub&gt;]·9H&lt;sub&gt;2&lt;/sub&gt;O were determined employing a Rigaku Mercury375R/M CCD (XtaLAB mini) diffractometer with graphite monochromated Mo-Kα radiation. For [Rh&lt;sub&gt;2&lt;/sub&gt;(N-{2,4,6-CH&lt;sub&gt;3&lt;/sub&gt;}C&lt;sub&gt;6&lt;/sub&gt;H&lt;sub&gt;2&lt;/sub&gt;)COCH&lt;sub&gt;3&lt;/sub&gt;)&lt;sub&gt;4&lt;/sub&gt;]·2NCC&lt;sub&gt;6&lt;/sub&gt;H&lt;sub&gt;5&lt;/sub&gt;, the space group was P-421c(#114) with unit cell dimensions: a =11.0169(14)Å, c =21.499(3)Å, V = 2609.4(6)Å&lt;sup&gt;3&lt;/sup&gt;. Each rhodium had approximately octahedral coordination and was bound to another rhodium atom, two nitrogens (&lt;em&gt;trans&lt;/em&gt; to each other), two oxygens (&lt;em&gt;trans&lt;/em&gt; to each other), and one benzonitrile nitrogen (&lt;em&gt;trans&lt;/em&gt; to rhodium). For Ba&lt;sub&gt;1.5&lt;/sub&gt;[Fe(C&lt;sub&gt;10&lt;/sub&gt;H&lt;sub&gt;13&lt;/sub&gt;N&lt;sub&gt;2&lt;/sub&gt;O&lt;sub&gt;7&lt;/sub&gt;)][Co(CN)&lt;sub&gt;6&lt;/sub&gt;]·9H&lt;sub&gt;2&lt;/sub&gt;O the space group was: P-1(#2) with unit cell dimensions: a=13.634Å, b=13.768Å, c=17.254Å and α=84.795°, β=87.863°, γ=78.908°, V=3164.5Å&lt;sup&gt;3&lt;/sup&gt;. The iron atom (nearly octahedral) was coordinated to one chelating ligand (derived from ethylenediaminetetraacetic acid) and the nitrogen of a cyanide ligand. The carbon of the cyanide ligand was bound to cobalt (octahedral). Thus, the cyanide ligand serves as a bridge between the two metals.&lt;/p&gt;","abstract_has_math":false,"creators":["Kpogo, Kenneth K"],"institution":null,"degree_name":"MS (Master of Science)","degree_level":"Thesis - unrestricted","degree_discipline":"Chemistry","degree_department":null,"school":null,"contributors":[],"advisors":[],"committee_chairs":[],"committee_members":[],"year":2013,"date_issued":"2013-08-01T07:00:00Z","date_published":"2013-08-01T07:00:00Z","updated_at":"2026-07-24T02:19:59Z","subjects":["X-ray Crystal Structure","dirhodium","Barium","Iron","Cobalt","EDTA","HEDTA","Phenylacetamide","dimeric rhodium","iron-nitrile-cobalt","cobalt-nitrile-iron","Rh2L4","Chemistry","Inorganic Chemistry"],"languages":[],"rights":["Copyright by the authors."],"rights_urls":[],"identifier_entries":[]},"links":{"outbound_url":"https://dc.etsu.edu/etd/1175","outbound_label":"Repository record","outbound_source":"dc:identifier"},"metadata_groups":[{"id":"people","label":"People","entries":[{"key":"dc:creator","label":"Author","values":["Kpogo, Kenneth K"]}]},{"id":"academic_context","label":"Academic Context","entries":[{"key":"dc:date.available","label":"Dc Date Available","values":["2013-04-16T07:00:00Z"]},{"key":"dc:date.issued","label":"Date","values":["2013-08-01T07:00:00Z"]},{"key":"thesis:degree_discipline","label":"Discipline","values":["Chemistry"]},{"key":"thesis:degree_level","label":"Degree Level","values":["Thesis - unrestricted"]},{"key":"thesis:degree_name","label":"Degree Name","values":["MS (Master of Science)"]}]},{"id":"subjects_keywords","label":"Subjects and Keywords","entries":[{"key":"dc:subject","label":"Dc Subject","values":["X-ray Crystal Structure","dirhodium","Barium","Iron","Cobalt","EDTA","HEDTA","Phenylacetamide","dimeric rhodium","iron-nitrile-cobalt","cobalt-nitrile-iron","Rh2L4","Chemistry","Inorganic Chemistry"]}]},{"id":"language_rights","label":"Language and Rights","entries":[{"key":"dc:rights","label":"Dc Rights","values":["Copyright by the authors."]}]},{"id":"identifiers","label":"Identifiers","entries":[{"key":"dc:identifier","label":"Identifier","values":["https://dc.etsu.edu/context/etd/article/2343/viewcontent/KpogoK053113f.pdf","https://dc.etsu.edu/etd/1175"]}]},{"id":"additional","label":"Additional Metadata","entries":[{"key":"dc:description.abstract","label":"Abstract","values":["<p>The novel compound, [Rh<sub>2</sub>(N-{2,4,6-CH<sub>3</sub>}C<sub>6</sub>H<sub>2</sub>)COCH<sub>3</sub>)<sub>4</sub>] was synthesized. Crystal structures of [Rh<sub>2</sub>(N-{2,4,6-CH<sub>3</sub>}C<sub>6</sub>H<sub>2</sub>)COCH<sub>3</sub>)<sub>4</sub>]·2NCC<sub>6</sub>H<sub>5</sub> and Ba<sub>1.5</sub>[Fe(C<sub>10</sub>H<sub>13</sub>N<sub>2</sub>O<sub>7</sub>)][Co(CN)<sub>6</sub>]·9H<sub>2</sub>O were determined employing a Rigaku Mercury375R/M CCD (XtaLAB mini) diffractometer with graphite monochromated Mo-Kα radiation. For [Rh<sub>2</sub>(N-{2,4,6-CH<sub>3</sub>}C<sub>6</sub>H<sub>2</sub>)COCH<sub>3</sub>)<sub>4</sub>]·2NCC<sub>6</sub>H<sub>5</sub>, the space group was P-421c(#114) with unit cell dimensions: a =11.0169(14)Å, c =21.499(3)Å, V = 2609.4(6)Å<sup>3</sup>. Each rhodium had approximately octahedral coordination and was bound to another rhodium atom, two nitrogens (<em>trans</em> to each other), two oxygens (<em>trans</em> to each other), and one benzonitrile nitrogen (<em>trans</em> to rhodium). For Ba<sub>1.5</sub>[Fe(C<sub>10</sub>H<sub>13</sub>N<sub>2</sub>O<sub>7</sub>)][Co(CN)<sub>6</sub>]·9H<sub>2</sub>O the space group was: P-1(#2) with unit cell dimensions: a=13.634Å, b=13.768Å, c=17.254Å and α=84.795°, β=87.863°, γ=78.908°, V=3164.5Å<sup>3</sup>. The iron atom (nearly octahedral) was coordinated to one chelating ligand (derived from ethylenediaminetetraacetic acid) and the nitrogen of a cyanide ligand. The carbon of the cyanide ligand was bound to cobalt (octahedral). Thus, the cyanide ligand serves as a bridge between the two metals.</p>"]},{"key":"dc:title","label":"Title","values":["X-ray crystal structures of: [Rh2(N-{2,4,6-CH3}C6H2)COCH3)4]•2NCC6H4 AND Ba1.5[Fe(C10H13N2O7)][Co(CN)6]•9H2O; two crystallographic challenges"]}]}],"canonical_facts":{"dc:creator":["Kpogo, Kenneth K"],"dc:date.available":["2013-04-16T07:00:00Z"],"dc:date.issued":["2013-08-01T07:00:00Z"],"dc:description.abstract":["<p>The novel compound, [Rh<sub>2</sub>(N-{2,4,6-CH<sub>3</sub>}C<sub>6</sub>H<sub>2</sub>)COCH<sub>3</sub>)<sub>4</sub>] was synthesized. Crystal structures of [Rh<sub>2</sub>(N-{2,4,6-CH<sub>3</sub>}C<sub>6</sub>H<sub>2</sub>)COCH<sub>3</sub>)<sub>4</sub>]·2NCC<sub>6</sub>H<sub>5</sub> and Ba<sub>1.5</sub>[Fe(C<sub>10</sub>H<sub>13</sub>N<sub>2</sub>O<sub>7</sub>)][Co(CN)<sub>6</sub>]·9H<sub>2</sub>O were determined employing a Rigaku Mercury375R/M CCD (XtaLAB mini) diffractometer with graphite monochromated Mo-Kα radiation. For [Rh<sub>2</sub>(N-{2,4,6-CH<sub>3</sub>}C<sub>6</sub>H<sub>2</sub>)COCH<sub>3</sub>)<sub>4</sub>]·2NCC<sub>6</sub>H<sub>5</sub>, the space group was P-421c(#114) with unit cell dimensions: a =11.0169(14)Å, c =21.499(3)Å, V = 2609.4(6)Å<sup>3</sup>. Each rhodium had approximately octahedral coordination and was bound to another rhodium atom, two nitrogens (<em>trans</em> to each other), two oxygens (<em>trans</em> to each other), and one benzonitrile nitrogen (<em>trans</em> to rhodium). For Ba<sub>1.5</sub>[Fe(C<sub>10</sub>H<sub>13</sub>N<sub>2</sub>O<sub>7</sub>)][Co(CN)<sub>6</sub>]·9H<sub>2</sub>O the space group was: P-1(#2) with unit cell dimensions: a=13.634Å, b=13.768Å, c=17.254Å and α=84.795°, β=87.863°, γ=78.908°, V=3164.5Å<sup>3</sup>. The iron atom (nearly octahedral) was coordinated to one chelating ligand (derived from ethylenediaminetetraacetic acid) and the nitrogen of a cyanide ligand. The carbon of the cyanide ligand was bound to cobalt (octahedral). Thus, the cyanide ligand serves as a bridge between the two metals.</p>"],"dc:identifier":["https://dc.etsu.edu/context/etd/article/2343/viewcontent/KpogoK053113f.pdf","https://dc.etsu.edu/etd/1175"],"dc:rights":["Copyright by the authors."],"dc:subject":["X-ray Crystal Structure","dirhodium","Barium","Iron","Cobalt","EDTA","HEDTA","Phenylacetamide","dimeric rhodium","iron-nitrile-cobalt","cobalt-nitrile-iron","Rh2L4","Chemistry","Inorganic Chemistry"],"dc:title":["X-ray crystal structures of: [Rh2(N-{2,4,6-CH3}C6H2)COCH3)4]•2NCC6H4 AND Ba1.5[Fe(C10H13N2O7)][Co(CN)6]•9H2O; two crystallographic challenges"],"thesis:degree_discipline":["Chemistry"],"thesis:degree_level":["Thesis - unrestricted"],"thesis:degree_name":["MS (Master of Science)"]},"updated_at":"2026-07-24T02:19:59Z"}