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(2.2.2-Cryptand)potassium bis­(cyanato-κN)(5,10,15,20-tetra­phenyl­por­phy­rin­ato-κ(4) N)cobaltate(III) chloro­benzene hemisolvate

In the title compound, [K(C(18)H(36)N(2)O(6))][Co(NCO)(2)(C(44)H(28)N(4))]·0.5C(6)H(5)Cl or [K(2,2,2-crypt)(+)][Co(III)(NCO)(2)(TPP)(−)]·0.5C(6)H(5)Cl, the Co(III) ion is octa­hedrally coordin­ated by two axial N-bonded NCO(−) anions and four pyrrole N atoms of the porphyrin. There is a major ruffli...

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Autores principales: Belhaj Ali, Bader, Belkhiria, Mohamed Salah, Daran, Jean-Claude, Nasri, Habib
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2012
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3470147/
https://www.ncbi.nlm.nih.gov/pubmed/23125591
http://dx.doi.org/10.1107/S1600536812038317
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author Belhaj Ali, Bader
Belkhiria, Mohamed Salah
Daran, Jean-Claude
Nasri, Habib
author_facet Belhaj Ali, Bader
Belkhiria, Mohamed Salah
Daran, Jean-Claude
Nasri, Habib
author_sort Belhaj Ali, Bader
collection PubMed
description In the title compound, [K(C(18)H(36)N(2)O(6))][Co(NCO)(2)(C(44)H(28)N(4))]·0.5C(6)H(5)Cl or [K(2,2,2-crypt)(+)][Co(III)(NCO)(2)(TPP)(−)]·0.5C(6)H(5)Cl, the Co(III) 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].
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spelling pubmed-34701472012-11-02 (2.2.2-Cryptand)potassium bis­(cyanato-κN)(5,10,15,20-tetra­phenyl­por­phy­rin­ato-κ(4) N)cobaltate(III) chloro­benzene hemisolvate Belhaj Ali, Bader Belkhiria, Mohamed Salah Daran, Jean-Claude Nasri, Habib Acta Crystallogr Sect E Struct Rep Online Metal-Organic Papers In the title compound, [K(C(18)H(36)N(2)O(6))][Co(NCO)(2)(C(44)H(28)N(4))]·0.5C(6)H(5)Cl or [K(2,2,2-crypt)(+)][Co(III)(NCO)(2)(TPP)(−)]·0.5C(6)H(5)Cl, the Co(III) 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]. International Union of Crystallography 2012-09-15 /pmc/articles/PMC3470147/ /pubmed/23125591 http://dx.doi.org/10.1107/S1600536812038317 Text en © Belhaj Ali et al. 2012 http://creativecommons.org/licenses/by/2.0/uk/ 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.
spellingShingle Metal-Organic Papers
Belhaj Ali, Bader
Belkhiria, Mohamed Salah
Daran, Jean-Claude
Nasri, Habib
(2.2.2-Cryptand)potassium bis­(cyanato-κN)(5,10,15,20-tetra­phenyl­por­phy­rin­ato-κ(4) N)cobaltate(III) chloro­benzene hemisolvate
title (2.2.2-Cryptand)potassium bis­(cyanato-κN)(5,10,15,20-tetra­phenyl­por­phy­rin­ato-κ(4) N)cobaltate(III) chloro­benzene hemisolvate
title_full (2.2.2-Cryptand)potassium bis­(cyanato-κN)(5,10,15,20-tetra­phenyl­por­phy­rin­ato-κ(4) N)cobaltate(III) chloro­benzene hemisolvate
title_fullStr (2.2.2-Cryptand)potassium bis­(cyanato-κN)(5,10,15,20-tetra­phenyl­por­phy­rin­ato-κ(4) N)cobaltate(III) chloro­benzene hemisolvate
title_full_unstemmed (2.2.2-Cryptand)potassium bis­(cyanato-κN)(5,10,15,20-tetra­phenyl­por­phy­rin­ato-κ(4) N)cobaltate(III) chloro­benzene hemisolvate
title_short (2.2.2-Cryptand)potassium bis­(cyanato-κN)(5,10,15,20-tetra­phenyl­por­phy­rin­ato-κ(4) N)cobaltate(III) chloro­benzene hemisolvate
title_sort (2.2.2-cryptand)potassium bis­(cyanato-κn)(5,10,15,20-tetra­phenyl­por­phy­rin­ato-κ(4) n)cobaltate(iii) chloro­benzene hemisolvate
topic Metal-Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3470147/
https://www.ncbi.nlm.nih.gov/pubmed/23125591
http://dx.doi.org/10.1107/S1600536812038317
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