1-Phenylpiperazine-1,4-diium tetrachloridocobalt(II)
Identifieur interne : 000380 ( Pmc/Curation ); précédent : 000379; suivant : 0003811-Phenylpiperazine-1,4-diium tetrachloridocobalt(II)
Auteurs : Abdelhamid Chiheb Dhieb [Tunisie] ; Daron E. Janzen [États-Unis] ; Mohamed Rzaigui [Tunisie] ; Wajda Smirani Sta [Tunisie]Source :
- Acta Crystallographica Section E: Structure Reports Online [ 1600-5368 ] ; 2014.
Abstract
In the title molecular salt, (C10H16N2)[CoCl4], the piperazine ring of the phenylpiperazine dication adopts a chair conformation and the phenyl ring occupies an equatorial orientation. In the tetrachloridocobaltate(II) dianion, the Co—Cl bond lengths for the chloride ions not accepting hydrogen bonds are significantly shorter than those for the chloride ions accepting such bonds. In the crystal, the components are linked by N—H⋯Cl hydrogen bonds, generating [001] chains.
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DOI: 10.1107/S1600536814005790
PubMed: 24826100
PubMed Central: 3998532
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Janzen</name><affiliation wicri:level="1"><nlm:aff id="b">Department of Chemistry and Biochemistry, St Catherine University, 2004 Randolph Avenue, #4282, St Paul, MN 55105,<country>USA</country></nlm:aff><country xml:lang="fr">États-Unis</country><wicri:regionArea># see nlm:aff country strict</wicri:regionArea></affiliation></author><author><name sortKey="Rzaigui, Mohamed" sort="Rzaigui, Mohamed" uniqKey="Rzaigui M" first="Mohamed" last="Rzaigui">Mohamed Rzaigui</name><affiliation wicri:level="1"><nlm:aff id="a">Laboratoire de Chimie des Matériaux, Faculté des Sciences de Bizerte, 7021 Zarzouna Bizerte,<country>Tunisia</country></nlm:aff><country xml:lang="fr">Tunisie</country><wicri:regionArea># see nlm:aff country strict</wicri:regionArea></affiliation></author><author><name sortKey="Smirani Sta, Wajda" sort="Smirani Sta, Wajda" uniqKey="Smirani Sta W" first="Wajda" last="Smirani Sta">Wajda Smirani Sta</name><affiliation wicri:level="1"><nlm:aff id="a">Laboratoire de Chimie des Matériaux, Faculté des Sciences de Bizerte, 7021 Zarzouna Bizerte,<country>Tunisia</country></nlm:aff><country xml:lang="fr">Tunisie</country><wicri:regionArea># see nlm:aff country strict</wicri:regionArea></affiliation></author></analytic><series><title level="j">Acta Crystallographica Section E: Structure Reports Online</title><idno type="eISSN">1600-5368</idno><imprint><date when="2014">2014</date></imprint></series></biblStruct></sourceDesc></fileDesc><profileDesc><textClass></textClass></profileDesc></teiHeader><front><div type="abstract" xml:lang="en"><p>In the title molecular salt, (C<sub>10</sub>H<sub>16</sub>N<sub>2</sub>)[CoCl<sub>4</sub>], the piperazine ring of the phenylpiperazine dication adopts a chair conformation and the phenyl ring occupies an equatorial orientation. In the tetrachloridocobaltate(II) dianion, the Co—Cl bond lengths for the chloride ions not accepting hydrogen bonds are significantly shorter than those for the chloride ions accepting such bonds. In the crystal, the components are linked by N—H⋯Cl hydrogen bonds, generating [001] chains.</p></div></front><back><div1 type="bibliography"><listBibl><biblStruct></biblStruct><biblStruct></biblStruct><biblStruct></biblStruct><biblStruct></biblStruct><biblStruct></biblStruct><biblStruct></biblStruct><biblStruct></biblStruct><biblStruct></biblStruct><biblStruct></biblStruct><biblStruct></biblStruct><biblStruct></biblStruct></listBibl></div1></back></TEI><pmc article-type="research-article"><pmc-dir>properties open_access</pmc-dir>
<front><journal-meta><journal-id journal-id-type="nlm-ta">Acta Crystallogr Sect E Struct Rep Online</journal-id><journal-id journal-id-type="iso-abbrev">Acta Crystallogr Sect E Struct Rep Online</journal-id><journal-id journal-id-type="publisher-id">Acta Cryst. E</journal-id><journal-title-group><journal-title>Acta Crystallographica Section E: Structure Reports Online</journal-title></journal-title-group><issn pub-type="epub">1600-5368</issn><publisher><publisher-name>International Union of Crystallography</publisher-name></publisher></journal-meta><article-meta><article-id pub-id-type="pmid">24826100</article-id><article-id pub-id-type="pmc">3998532</article-id><article-id pub-id-type="publisher-id">hb7210</article-id><article-id pub-id-type="doi">10.1107/S1600536814005790</article-id><article-id pub-id-type="coden">ACSEBH</article-id><article-id pub-id-type="pii">S1600536814005790</article-id><article-categories><subj-group subj-group-type="heading"><subject>Metal-Organic Papers</subject></subj-group></article-categories><title-group><article-title>1-Phenylpiperazine-1,4-diium tetrachloridocobalt(II)</article-title><alt-title><italic>(C<sub>10</sub>H<sub>16</sub>N<sub>2</sub>)[CoCl<sub>4</sub>]</italic></alt-title></title-group><contrib-group><contrib contrib-type="author"><name><surname>Dhieb</surname><given-names>Abdelhamid Chiheb</given-names></name><xref ref-type="aff" rid="a">a</xref></contrib><contrib contrib-type="author"><name><surname>Janzen</surname><given-names>Daron E.</given-names></name><xref ref-type="aff" rid="b">b</xref></contrib><contrib contrib-type="author"><name><surname>Rzaigui</surname><given-names>Mohamed</given-names></name><xref ref-type="aff" rid="a">a</xref></contrib><contrib contrib-type="author"><name><surname>Smirani Sta</surname><given-names>Wajda</given-names></name><xref ref-type="aff" rid="a">a</xref><xref ref-type="corresp" rid="cor">*</xref></contrib><aff id="a"><label>a</label>Laboratoire de Chimie des Matériaux, Faculté des Sciences de Bizerte, 7021 Zarzouna Bizerte,<country>Tunisia</country></aff><aff id="b"><label>b</label>Department of Chemistry and Biochemistry, St Catherine University, 2004 Randolph Avenue, #4282, St Paul, MN 55105,<country>USA</country></aff></contrib-group><author-notes><corresp id="cor">Correspondence e-mail: <email>wajda_sta@yahoo.fr</email></corresp></author-notes><pub-date pub-type="collection"><day>01</day><month>4</month><year>2014</year></pub-date><pub-date pub-type="epub"><day>22</day><month>3</month><year>2014</year></pub-date><pub-date pub-type="pmc-release"><day>22</day><month>3</month><year>2014</year></pub-date><pmc-comment> PMC Release delay is 0 months and 0 days and was based on the
<volume>70</volume><issue>Pt 4</issue><issue-id pub-id-type="publisher-id">e140400</issue-id><fpage>m139</fpage><lpage>m139</lpage><history><date date-type="received"><day>12</day><month>3</month><year>2014</year></date><date date-type="accepted"><day>14</day><month>3</month><year>2014</year></date></history><permissions><copyright-statement>© Dhieb et al. 2014</copyright-statement><copyright-year>2014</copyright-year><license license-type="open-access" xlink:href="http://creativecommons.org/licenses/by/2.0/uk/"><license-p>This is an open-access article distributed under the terms of the Creative Commons Attribution Licence, which permits
unrestricted use, distribution, and reproduction in any medium, provided the original authors and source are cited.</license-p></license></permissions><self-uri xlink:type="simple" xlink:href="http://dx.doi.org/10.1107/S1600536814005790">A full version of this article is available from Crystallography Journals Online.</self-uri><abstract><p>In the title molecular salt, (C<sub>10</sub>H<sub>16</sub>N<sub>2</sub>)[CoCl<sub>4</sub>], the piperazine ring of the phenylpiperazine dication adopts a chair conformation and the phenyl ring occupies an equatorial orientation. In the tetrachloridocobaltate(II) dianion, the Co—Cl bond lengths for the chloride ions not accepting hydrogen bonds are significantly shorter than those for the chloride ions accepting such bonds. In the crystal, the components are linked by N—H⋯Cl hydrogen bonds, generating [001] chains.</p></abstract></article-meta></front><floats-group><table-wrap id="table1" position="float"><label>Table 1</label><caption><title>Selected bond lengths (Å)</title></caption><table frame="hsides" rules="groups"><tbody valign="top"><tr><td style="" rowspan="1" colspan="1" align="left" valign="top">Co1—Cl1</td><td style="" rowspan="1" colspan="1" align="char" valign="top">2.3182 (5)</td></tr><tr><td style="" rowspan="1" colspan="1" align="left" valign="top">Co1—Cl2</td><td style="" rowspan="1" colspan="1" align="char" valign="top">2.2431 (5)</td></tr><tr><td style="" rowspan="1" colspan="1" align="left" valign="top">Co1—Cl3</td><td style="" rowspan="1" colspan="1" align="char" valign="top">2.2738 (5)</td></tr><tr><td style="" rowspan="1" colspan="1" align="left" valign="top">Co1—Cl4</td><td style="" rowspan="1" colspan="1" align="char" valign="top">2.2811 (6)</td></tr></tbody></table></table-wrap><table-wrap id="table2" position="float"><label>Table 2</label><caption><title>Hydrogen-bond geometry (Å, °)</title></caption><table frame="hsides" rules="groups"><thead valign="bottom"><tr><th style="border-bottom:1px solid black;" rowspan="1" colspan="1" align="left" valign="bottom"><italic>D</italic>—H⋯<italic>A</italic></th><th style="border-bottom:1px solid black;" rowspan="1" colspan="1" align="left" valign="bottom"><italic>D</italic>—H</th><th style="border-bottom:1px solid black;" rowspan="1" colspan="1" align="left" valign="bottom">H⋯<italic>A</italic></th><th style="border-bottom:1px solid black;" rowspan="1" colspan="1" align="left" valign="bottom"><italic>D</italic>⋯<italic>A</italic></th><th style="border-bottom:1px solid black;" rowspan="1" colspan="1" align="left" valign="bottom"><italic>D</italic>—H⋯<italic>A</italic></th></tr></thead><tbody valign="top"><tr><td style="" rowspan="1" colspan="1" align="left" valign="top">N1—H1<italic>A</italic>⋯Cl4</td><td style="" rowspan="1" colspan="1" align="left" valign="top">0.90 (3)</td><td style="" rowspan="1" colspan="1" align="left" valign="top">2.21 (3)</td><td style="" rowspan="1" colspan="1" align="left" valign="top">3.1043 (14)</td><td style="" rowspan="1" colspan="1" align="left" valign="top">173 (3)</td></tr><tr><td style="" rowspan="1" colspan="1" align="left" valign="top">N1—H1<italic>B</italic>⋯Cl1<sup>i</sup></td><td style="" rowspan="1" colspan="1" align="left" valign="top">0.85 (2)</td><td style="" rowspan="1" colspan="1" align="left" valign="top">2.66 (3)</td><td style="" rowspan="1" colspan="1" align="left" valign="top">3.2963 (14)</td><td style="" rowspan="1" colspan="1" align="left" valign="top">132.2 (18)</td></tr><tr><td style="" rowspan="1" colspan="1" align="left" valign="top">N2—H2⋯Cl1<sup>ii</sup></td><td style="" rowspan="1" colspan="1" align="left" valign="top">0.89 (3)</td><td style="" rowspan="1" colspan="1" align="left" valign="top">2.36 (2)</td><td style="" rowspan="1" colspan="1" align="left" valign="top">3.2262 (13)</td><td style="" rowspan="1" colspan="1" align="left" valign="top">164.6 (17)</td></tr></tbody></table><table-wrap-foot><p>Symmetry codes: (i) <inline-formula><inline-graphic xlink:href="e-70-0m139-efi2.jpg" mimetype="image" mime-subtype="gif"></inline-graphic></inline-formula>; (ii) <inline-formula><inline-graphic xlink:href="e-70-0m139-efi3.jpg" mimetype="image" mime-subtype="gif"></inline-graphic></inline-formula>.</p></table-wrap-foot></table-wrap></floats-group></pmc></record>Pour manipuler ce document sous Unix (Dilib)
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