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(2.2.2-Cryptand)potassium bis­(cyanato-κN)(5,10,15,20-tetra­phenyl­por­phy­rin­ato-κ4N)cobaltate(III) chloro­benzene hemisolvate

Identifieur interne : 000057 ( France/Analysis ); précédent : 000056; suivant : 000058

(2.2.2-Cryptand)potassium bis­(cyanato-κN)(5,10,15,20-tetra­phenyl­por­phy­rin­ato-κ4N)cobaltate(III) chloro­benzene hemisolvate

Auteurs : Bader Belhaj Ali [Tunisie] ; Mohamed Salah Belkhiria [Tunisie] ; Jean-Claude Daran [France] ; Habib Nasri [Tunisie]

Source :

RBID : PMC:3470147

Abstract

In the title compound, [K(C18H36N2O6)][Co(NCO)2(C44H28N4)]·0.5C6H5Cl or [K(2,2,2-crypt)+][CoIII(NCO)2(TPP)]·0.5C6H5Cl, the CoIII ion is octa­hedrally coordin­ated by two axial N-bonded NCO anions and four pyrrole N atoms of the porphyrin. There is a major ruffling distortion of the porphyrin: the dihedral angles between trans pyrrole rings are 34.32 (14) and 34.72 (14)°. The potassium ion is coordinated by the six O atoms and two N atoms of the cryptand-222 mol­ecule and a weak K—O [3.407 (3) Å] bond to one of the cyanate O atoms also occurs. The packing also features weak C—H⋯O and C—H⋯π inter­actions. The contribution to the scattering of the disordered chloro­benzene solvent mol­ecules was removed with the SQUEEZE function in PLATON [Spek (2009). Acta Cryst. D65, 148–155].


Url:
DOI: 10.1107/S1600536812038317
PubMed: 23125591
PubMed Central: 3470147


Affiliations:


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PMC:3470147

Le document en format XML

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<title xml:lang="en">(2.2.2-Cryptand)potassium bis­(cyanato-κ
<italic>N</italic>
)(5,10,15,20-tetra­phenyl­por­phy­rin­ato-κ
<sup>4</sup>
<italic>N</italic>
)cobaltate(III) chloro­benzene hemisolvate</title>
<author>
<name sortKey="Belhaj Ali, Bader" sort="Belhaj Ali, Bader" uniqKey="Belhaj Ali B" first="Bader" last="Belhaj Ali">Bader Belhaj Ali</name>
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<title xml:lang="en" level="a" type="main">(2.2.2-Cryptand)potassium bis­(cyanato-κ
<italic>N</italic>
)(5,10,15,20-tetra­phenyl­por­phy­rin­ato-κ
<sup>4</sup>
<italic>N</italic>
)cobaltate(III) chloro­benzene hemisolvate</title>
<author>
<name sortKey="Belhaj Ali, Bader" sort="Belhaj Ali, Bader" uniqKey="Belhaj Ali B" first="Bader" last="Belhaj Ali">Bader Belhaj Ali</name>
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<country>Tunisia</country>
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<country xml:lang="fr">Tunisie</country>
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<name sortKey="Belkhiria, Mohamed Salah" sort="Belkhiria, Mohamed Salah" uniqKey="Belkhiria M" first="Mohamed Salah" last="Belkhiria">Mohamed Salah Belkhiria</name>
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<country xml:lang="fr">France</country>
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<p>In the title compound, [K(C
<sub>18</sub>
H
<sub>36</sub>
N
<sub>2</sub>
O
<sub>6</sub>
)][Co(NCO)
<sub>2</sub>
(C
<sub>44</sub>
H
<sub>28</sub>
N
<sub>4</sub>
)]·0.5C
<sub>6</sub>
H
<sub>5</sub>
Cl or [K(2,2,2-crypt)
<sup>+</sup>
][Co
<sup>III</sup>
(NCO)
<sub>2</sub>
(TPP)
<sup></sup>
]·0.5C
<sub>6</sub>
H
<sub>5</sub>
Cl, the Co
<sup>III</sup>
ion is octa­hedrally coordin­ated by two axial N-bonded NCO
<sup></sup>
anions and four pyrrole N atoms of the porphyrin. There is a major ruffling distortion of the porphyrin: the dihedral angles between
<italic>trans</italic>
pyrrole rings are 34.32 (14) and 34.72 (14)°. The potassium ion is coordinated by the six O atoms and two N atoms of the cryptand-222 mol­ecule and a weak K—O [3.407 (3) Å] bond to one of the cyanate O atoms also occurs. The packing also features weak C—H⋯O and C—H⋯π inter­actions. The contribution to the scattering of the disordered chloro­benzene solvent mol­ecules was removed with the SQUEEZE function in
<italic>PLATON</italic>
[Spek (2009
<xref ref-type="bibr" rid="bb17"></xref>
).
<italic>Acta Cryst.</italic>
D
<bold>65</bold>
, 148–155].</p>
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