Serveur d'exploration sur le cobalt au Maghreb

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trans-Diaqua­bis­[2,5-bis­(pyridin-2-yl)-1,3,4-thia­diazole]cobalt(II) bis­(tetra­fluoridoborate)

Identifieur interne : 000298 ( Pmc/Checkpoint ); précédent : 000297; suivant : 000299

trans-Diaqua­bis­[2,5-bis­(pyridin-2-yl)-1,3,4-thia­diazole]cobalt(II) bis­(tetra­fluoridoborate)

Auteurs : Fouad Bentiss [Maroc] ; Frédéric Capet [France] ; Michel Lagrenée [France] ; Mohamed Saadi [Maroc] ; Lahcen El Ammari [Maroc]

Source :

RBID : PMC:3151744

Abstract

The bidentate 1,3,4-thia­diazole ligand substituted by two 2-pyridyl rings (denoted L) has been found to produce the new monomeric title complex, [Co(C12H8N4S)2(H2O)2](BF4)2. The thia­diazole and pyridyl rings surrounding the Co atom are almost coplanar [dihedral angle = 4.35 (7)°]. The mean plane defined by these heterocyclic moieties makes a dihedral angle of 18.72 (6)° with the non-coordinated pyridyl ring. The Co2+ cation, located at a crystallographic center of symmetry, is bonded to two ligands and two water mol­ecules in a trans configuration in an octa­hedral environment. The tetra­fluorido­­borate ions can be regarded as free anions in the crystal lattice. Nevertheless, they are involved in an infinite two-dimensional network along the [010] and [101] directions of O—H⋯F hydrogen bonds.


Url:
DOI: 10.1107/S1600536811020125
PubMed: 21836842
PubMed Central: 3151744


Affiliations:


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PMC:3151744

Le document en format XML

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-Diaqua­bis­[2,5-bis­(pyridin-2-yl)-1,3,4-thia­diazole]cobalt(II) bis­(tetra­fluoridoborate)</title>
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<name sortKey="Capet, Frederic" sort="Capet, Frederic" uniqKey="Capet F" first="Frédéric" last="Capet">Frédéric Capet</name>
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<nlm:aff id="b">Unité de Catalyse et de Chimie du Solide (UCCS), CNRS UMR 8181, ENSCL, BP 90108, F-59652 Villeneuve d’Ascq Cedex,
<country>France</country>
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<name sortKey="Lagrenee, Michel" sort="Lagrenee, Michel" uniqKey="Lagrenee M" first="Michel" last="Lagrenée">Michel Lagrenée</name>
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<country xml:lang="fr">Maroc</country>
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<name sortKey="El Ammari, Lahcen" sort="El Ammari, Lahcen" uniqKey="El Ammari L" first="Lahcen" last="El Ammari">Lahcen El Ammari</name>
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<italic>trans</italic>
-Diaqua­bis­[2,5-bis­(pyridin-2-yl)-1,3,4-thia­diazole]cobalt(II) bis­(tetra­fluoridoborate)</title>
<author>
<name sortKey="Bentiss, Fouad" sort="Bentiss, Fouad" uniqKey="Bentiss F" first="Fouad" last="Bentiss">Fouad Bentiss</name>
<affiliation wicri:level="1">
<nlm:aff id="a">Laboratoire de Chimie de Coordination et d’Analytique (LCCA), Faculté des Sciences, Université Chouaib Doukkali, BP 20, M-24000 El Jadida,
<country>Morocco</country>
</nlm:aff>
<country xml:lang="fr">Maroc</country>
<wicri:regionArea># see nlm:aff country strict</wicri:regionArea>
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<author>
<name sortKey="Capet, Frederic" sort="Capet, Frederic" uniqKey="Capet F" first="Frédéric" last="Capet">Frédéric Capet</name>
<affiliation wicri:level="1">
<nlm:aff id="b">Unité de Catalyse et de Chimie du Solide (UCCS), CNRS UMR 8181, ENSCL, BP 90108, F-59652 Villeneuve d’Ascq Cedex,
<country>France</country>
</nlm:aff>
<country xml:lang="fr">France</country>
<wicri:regionArea># see nlm:aff country strict</wicri:regionArea>
</affiliation>
<affiliation wicri:level="1">
<nlm:aff id="c">Université Lille Nord de France, F-59000 Lille,
<country>France</country>
</nlm:aff>
<country xml:lang="fr">France</country>
<wicri:regionArea># see nlm:aff country strict</wicri:regionArea>
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</author>
<author>
<name sortKey="Lagrenee, Michel" sort="Lagrenee, Michel" uniqKey="Lagrenee M" first="Michel" last="Lagrenée">Michel Lagrenée</name>
<affiliation wicri:level="1">
<nlm:aff id="b">Unité de Catalyse et de Chimie du Solide (UCCS), CNRS UMR 8181, ENSCL, BP 90108, F-59652 Villeneuve d’Ascq Cedex,
<country>France</country>
</nlm:aff>
<country xml:lang="fr">France</country>
<wicri:regionArea># see nlm:aff country strict</wicri:regionArea>
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<country>France</country>
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<country xml:lang="fr">France</country>
<wicri:regionArea># see nlm:aff country strict</wicri:regionArea>
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<name sortKey="Saadi, Mohamed" sort="Saadi, Mohamed" uniqKey="Saadi M" first="Mohamed" last="Saadi">Mohamed Saadi</name>
<affiliation wicri:level="1">
<nlm:aff id="d">Laboratoire de Chimie du Solide Appliquée, Faculté des Sciences, Université Mohammed V-Agdal, Avenue Ibn Battouta, BP 1014, Rabat,
<country>Morocco</country>
</nlm:aff>
<country xml:lang="fr">Maroc</country>
<wicri:regionArea># see nlm:aff country strict</wicri:regionArea>
</affiliation>
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<author>
<name sortKey="El Ammari, Lahcen" sort="El Ammari, Lahcen" uniqKey="El Ammari L" first="Lahcen" last="El Ammari">Lahcen El Ammari</name>
<affiliation wicri:level="1">
<nlm:aff id="d">Laboratoire de Chimie du Solide Appliquée, Faculté des Sciences, Université Mohammed V-Agdal, Avenue Ibn Battouta, BP 1014, Rabat,
<country>Morocco</country>
</nlm:aff>
<country xml:lang="fr">Maroc</country>
<wicri:regionArea># see nlm:aff country strict</wicri:regionArea>
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<title level="j">Acta Crystallographica Section E: Structure Reports Online</title>
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<date when="2011">2011</date>
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<p>The bidentate 1,3,4-thia­diazole ligand substituted by two 2-pyridyl rings (denoted
<italic>L</italic>
) has been found to produce the new monomeric title complex, [Co(C
<sub>12</sub>
H
<sub>8</sub>
N
<sub>4</sub>
S)
<sub>2</sub>
(H
<sub>2</sub>
O)
<sub>2</sub>
](BF
<sub>4</sub>
)
<sub>2</sub>
. The thia­diazole and pyridyl rings surrounding the Co atom are almost coplanar [dihedral angle = 4.35 (7)°]. The mean plane defined by these heterocyclic moieties makes a dihedral angle of 18.72 (6)° with the non-coordinated pyridyl ring. The Co
<sup>2+</sup>
cation, located at a crystallographic center of symmetry, is bonded to two ligands and two water mol­ecules in a
<italic>trans</italic>
configuration in an octa­hedral environment. The tetra­fluorido­­borate ions can be regarded as free anions in the crystal lattice. Nevertheless, they are involved in an infinite two-dimensional network along the [010] and [101] directions of O—H⋯F hydrogen bonds.</p>
</div>
</front>
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<front>
<journal-meta>
<journal-id journal-id-type="nlm-ta">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">21836842</article-id>
<article-id pub-id-type="pmc">3151744</article-id>
<article-id pub-id-type="publisher-id">im2290</article-id>
<article-id pub-id-type="doi">10.1107/S1600536811020125</article-id>
<article-id pub-id-type="coden">ACSEBH</article-id>
<article-id pub-id-type="pii">S1600536811020125</article-id>
<article-categories>
<subj-group subj-group-type="heading">
<subject>Metal-Organic Papers</subject>
</subj-group>
</article-categories>
<title-group>
<article-title>
<italic>trans</italic>
-Diaqua­bis­[2,5-bis­(pyridin-2-yl)-1,3,4-thia­diazole]cobalt(II) bis­(tetra­fluoridoborate)</article-title>
<alt-title>
<italic>[Co(C
<sub>12</sub>
H
<sub>8</sub>
N
<sub>4</sub>
S)
<sub>2</sub>
(H
<sub>2</sub>
O)
<sub>2</sub>
](BF
<sub>4</sub>
)
<sub>2</sub>
</italic>
</alt-title>
</title-group>
<contrib-group>
<contrib contrib-type="author">
<name>
<surname>Bentiss</surname>
<given-names>Fouad</given-names>
</name>
<xref ref-type="aff" rid="a">a</xref>
<xref ref-type="corresp" rid="cor">*</xref>
</contrib>
<contrib contrib-type="author">
<name>
<surname>Capet</surname>
<given-names>Frédéric</given-names>
</name>
<xref ref-type="aff" rid="b">b</xref>
<xref ref-type="aff" rid="c">c</xref>
</contrib>
<contrib contrib-type="author">
<name>
<surname>Lagrenée</surname>
<given-names>Michel</given-names>
</name>
<xref ref-type="aff" rid="b">b</xref>
<xref ref-type="aff" rid="c">c</xref>
</contrib>
<contrib contrib-type="author">
<name>
<surname>Saadi</surname>
<given-names>Mohamed</given-names>
</name>
<xref ref-type="aff" rid="d">d</xref>
</contrib>
<contrib contrib-type="author">
<name>
<surname>El Ammari</surname>
<given-names>Lahcen</given-names>
</name>
<xref ref-type="aff" rid="d">d</xref>
</contrib>
<aff id="a">
<label>a</label>
Laboratoire de Chimie de Coordination et d’Analytique (LCCA), Faculté des Sciences, Université Chouaib Doukkali, BP 20, M-24000 El Jadida,
<country>Morocco</country>
</aff>
<aff id="b">
<label>b</label>
Unité de Catalyse et de Chimie du Solide (UCCS), CNRS UMR 8181, ENSCL, BP 90108, F-59652 Villeneuve d’Ascq Cedex,
<country>France</country>
</aff>
<aff id="c">
<label>c</label>
Université Lille Nord de France, F-59000 Lille,
<country>France</country>
</aff>
<aff id="d">
<label>d</label>
Laboratoire de Chimie du Solide Appliquée, Faculté des Sciences, Université Mohammed V-Agdal, Avenue Ibn Battouta, BP 1014, Rabat,
<country>Morocco</country>
</aff>
</contrib-group>
<author-notes>
<corresp id="cor">Correspondence e-mail:
<email>f_bentiss@yahoo.fr</email>
</corresp>
</author-notes>
<pub-date pub-type="collection">
<day>01</day>
<month>7</month>
<year>2011</year>
</pub-date>
<pub-date pub-type="epub">
<day>04</day>
<month>6</month>
<year>2011</year>
</pub-date>
<pub-date pub-type="pmc-release">
<day>04</day>
<month>6</month>
<year>2011</year>
</pub-date>
<pmc-comment> PMC Release delay is 0 months and 0 days and was based on the . </pmc-comment>
<volume>67</volume>
<issue>Pt 7</issue>
<issue-id pub-id-type="publisher-id">e110700</issue-id>
<fpage>m834</fpage>
<lpage>m835</lpage>
<history>
<date date-type="received">
<day>18</day>
<month>5</month>
<year>2011</year>
</date>
<date date-type="accepted">
<day>26</day>
<month>5</month>
<year>2011</year>
</date>
</history>
<permissions>
<copyright-statement>© Bentiss et al. 2011</copyright-statement>
<copyright-year>2011</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/S1600536811020125">A full version of this article is available from Crystallography Journals Online.</self-uri>
<abstract>
<p>The bidentate 1,3,4-thia­diazole ligand substituted by two 2-pyridyl rings (denoted
<italic>L</italic>
) has been found to produce the new monomeric title complex, [Co(C
<sub>12</sub>
H
<sub>8</sub>
N
<sub>4</sub>
S)
<sub>2</sub>
(H
<sub>2</sub>
O)
<sub>2</sub>
](BF
<sub>4</sub>
)
<sub>2</sub>
. The thia­diazole and pyridyl rings surrounding the Co atom are almost coplanar [dihedral angle = 4.35 (7)°]. The mean plane defined by these heterocyclic moieties makes a dihedral angle of 18.72 (6)° with the non-coordinated pyridyl ring. The Co
<sup>2+</sup>
cation, located at a crystallographic center of symmetry, is bonded to two ligands and two water mol­ecules in a
<italic>trans</italic>
configuration in an octa­hedral environment. The tetra­fluorido­­borate ions can be regarded as free anions in the crystal lattice. Nevertheless, they are involved in an infinite two-dimensional network along the [010] and [101] directions of O—H⋯F hydrogen bonds.</p>
</abstract>
</article-meta>
</front>
<floats-group>
<table-wrap id="table1" position="float">
<label>Table 1</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">O1—H1
<italic>W</italic>
⋯F1
<sup>i</sup>
</td>
<td style="" rowspan="1" colspan="1" align="left" valign="top">0.86</td>
<td style="" rowspan="1" colspan="1" align="left" valign="top">1.88</td>
<td style="" rowspan="1" colspan="1" align="left" valign="top">2.7014 (16)</td>
<td style="" rowspan="1" colspan="1" align="left" valign="top">161</td>
</tr>
<tr>
<td style="" rowspan="1" colspan="1" align="left" valign="top">O1—H2
<italic>W</italic>
⋯F4</td>
<td style="" rowspan="1" colspan="1" align="left" valign="top">0.86</td>
<td style="" rowspan="1" colspan="1" align="left" valign="top">1.94</td>
<td style="" rowspan="1" colspan="1" align="left" valign="top">2.7927 (16)</td>
<td style="" rowspan="1" colspan="1" align="left" valign="top">172</td>
</tr>
</tbody>
</table>
<table-wrap-foot>
<p>Symmetry code: (i)
<inline-formula>
<inline-graphic xlink:href="e-67-0m834-efi2.jpg" mimetype="image" mime-subtype="gif"></inline-graphic>
</inline-formula>
.</p>
</table-wrap-foot>
</table-wrap>
</floats-group>
</pmc>
<affiliations>
<list>
<country>
<li>France</li>
<li>Maroc</li>
</country>
</list>
<tree>
<country name="Maroc">
<noRegion>
<name sortKey="Bentiss, Fouad" sort="Bentiss, Fouad" uniqKey="Bentiss F" first="Fouad" last="Bentiss">Fouad Bentiss</name>
</noRegion>
<name sortKey="El Ammari, Lahcen" sort="El Ammari, Lahcen" uniqKey="El Ammari L" first="Lahcen" last="El Ammari">Lahcen El Ammari</name>
<name sortKey="Saadi, Mohamed" sort="Saadi, Mohamed" uniqKey="Saadi M" first="Mohamed" last="Saadi">Mohamed Saadi</name>
</country>
<country name="France">
<noRegion>
<name sortKey="Capet, Frederic" sort="Capet, Frederic" uniqKey="Capet F" first="Frédéric" last="Capet">Frédéric Capet</name>
</noRegion>
<name sortKey="Capet, Frederic" sort="Capet, Frederic" uniqKey="Capet F" first="Frédéric" last="Capet">Frédéric Capet</name>
<name sortKey="Lagrenee, Michel" sort="Lagrenee, Michel" uniqKey="Lagrenee M" first="Michel" last="Lagrenée">Michel Lagrenée</name>
<name sortKey="Lagrenee, Michel" sort="Lagrenee, Michel" uniqKey="Lagrenee M" first="Michel" last="Lagrenée">Michel Lagrenée</name>
</country>
</tree>
</affiliations>
</record>

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