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Investigation of nitro–nitrito photoisomerization: crystal structures of trans-bis­(acetyl­acetonato-O,O′)(pyridine/4-methyl­pyridine/3-hy­droxy­pridine)nitro­cobalt(III)

The reaction cavities of the nitro groups in the title compounds, trans-bis­(acetyl­acetonato-κ(2) O,O′)(nitro)(pyridine-κN)cobalt(III), [Co(C(5)H(7)O(2))(2)(NO(2))(C(5)H(5)N)], (I), trans-bis­(acetyl­acetonato-κ(2) O,O′)(4-methyl­pyridine-κN)(nitro)cobalt(III), [Co(C(5)H(7)O(2))(2)(NO(2))(C(6)H(7)N...

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Autores principales: Ohba, Shigeru, Tsuchimoto, Masanobu, Miyazaki, Hiroki
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2018
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6218901/
https://www.ncbi.nlm.nih.gov/pubmed/30443397
http://dx.doi.org/10.1107/S2056989018014731
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author Ohba, Shigeru
Tsuchimoto, Masanobu
Miyazaki, Hiroki
author_facet Ohba, Shigeru
Tsuchimoto, Masanobu
Miyazaki, Hiroki
author_sort Ohba, Shigeru
collection PubMed
description The reaction cavities of the nitro groups in the title compounds, trans-bis­(acetyl­acetonato-κ(2) O,O′)(nitro)(pyridine-κN)cobalt(III), [Co(C(5)H(7)O(2))(2)(NO(2))(C(5)H(5)N)], (I), trans-bis­(acetyl­acetonato-κ(2) O,O′)(4-methyl­pyridine-κN)(nitro)cobalt(III), [Co(C(5)H(7)O(2))(2)(NO(2))(C(6)H(7)N)], (II), and trans-bis­(acetyl­acetonato-κ(2) O,O′)(3-hy­droxy­pyridine-κN)(nitro)cobalt(III) monohydrate, [Co(C(5)H(7)O(2))(2)(NO(2))(C(5)H(5)NO)]·H(2)O, (III), have been investigated to reveal that bifurcated inter­molecular C(py)—H⋯O,O contacts in (III) are unfeasible for the nitro–nitrito photochemical linkage isomerization process. In each structure, the pyridine ring and the Co atom lie on a crystallographic mirror plane; in (I) and (II) the nitro group lies in the same plane, whereas in (III), which crystallizes as a monohydrate, the nitro group is disordered over three orientations in a 0.672 (16):0.164 (8):0.164 (8) ratio; the water mol­ecule of crystallization is statistically disordered over two sites adjacent to the mirror plane. In the crystals of (I) and (II), the mol­ecules are linked into [100] chains by C—H⋯O hydrogen bonds, whereas the extended structure of (III) features (010) layers linked by O—H⋯O and C—H⋯O hydrogen bonds. Compounds (I) and (II) were refined as inversion twins.
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spelling pubmed-62189012018-11-15 Investigation of nitro–nitrito photoisomerization: crystal structures of trans-bis­(acetyl­acetonato-O,O′)(pyridine/4-methyl­pyridine/3-hy­droxy­pridine)nitro­cobalt(III) Ohba, Shigeru Tsuchimoto, Masanobu Miyazaki, Hiroki Acta Crystallogr E Crystallogr Commun Research Communications The reaction cavities of the nitro groups in the title compounds, trans-bis­(acetyl­acetonato-κ(2) O,O′)(nitro)(pyridine-κN)cobalt(III), [Co(C(5)H(7)O(2))(2)(NO(2))(C(5)H(5)N)], (I), trans-bis­(acetyl­acetonato-κ(2) O,O′)(4-methyl­pyridine-κN)(nitro)cobalt(III), [Co(C(5)H(7)O(2))(2)(NO(2))(C(6)H(7)N)], (II), and trans-bis­(acetyl­acetonato-κ(2) O,O′)(3-hy­droxy­pyridine-κN)(nitro)cobalt(III) monohydrate, [Co(C(5)H(7)O(2))(2)(NO(2))(C(5)H(5)NO)]·H(2)O, (III), have been investigated to reveal that bifurcated inter­molecular C(py)—H⋯O,O contacts in (III) are unfeasible for the nitro–nitrito photochemical linkage isomerization process. In each structure, the pyridine ring and the Co atom lie on a crystallographic mirror plane; in (I) and (II) the nitro group lies in the same plane, whereas in (III), which crystallizes as a monohydrate, the nitro group is disordered over three orientations in a 0.672 (16):0.164 (8):0.164 (8) ratio; the water mol­ecule of crystallization is statistically disordered over two sites adjacent to the mirror plane. In the crystals of (I) and (II), the mol­ecules are linked into [100] chains by C—H⋯O hydrogen bonds, whereas the extended structure of (III) features (010) layers linked by O—H⋯O and C—H⋯O hydrogen bonds. Compounds (I) and (II) were refined as inversion twins. International Union of Crystallography 2018-10-23 /pmc/articles/PMC6218901/ /pubmed/30443397 http://dx.doi.org/10.1107/S2056989018014731 Text en © Ohba et al. 2018 http://creativecommons.org/licenses/by/2.0/uk/ This is an open-access article distributed under the terms of the Creative Commons Attribution (CC-BY) Licence, which permits unrestricted use, distribution, and reproduction in any medium, provided the original authors and source are cited.http://creativecommons.org/licenses/by/2.0/uk/
spellingShingle Research Communications
Ohba, Shigeru
Tsuchimoto, Masanobu
Miyazaki, Hiroki
Investigation of nitro–nitrito photoisomerization: crystal structures of trans-bis­(acetyl­acetonato-O,O′)(pyridine/4-methyl­pyridine/3-hy­droxy­pridine)nitro­cobalt(III)
title Investigation of nitro–nitrito photoisomerization: crystal structures of trans-bis­(acetyl­acetonato-O,O′)(pyridine/4-methyl­pyridine/3-hy­droxy­pridine)nitro­cobalt(III)
title_full Investigation of nitro–nitrito photoisomerization: crystal structures of trans-bis­(acetyl­acetonato-O,O′)(pyridine/4-methyl­pyridine/3-hy­droxy­pridine)nitro­cobalt(III)
title_fullStr Investigation of nitro–nitrito photoisomerization: crystal structures of trans-bis­(acetyl­acetonato-O,O′)(pyridine/4-methyl­pyridine/3-hy­droxy­pridine)nitro­cobalt(III)
title_full_unstemmed Investigation of nitro–nitrito photoisomerization: crystal structures of trans-bis­(acetyl­acetonato-O,O′)(pyridine/4-methyl­pyridine/3-hy­droxy­pridine)nitro­cobalt(III)
title_short Investigation of nitro–nitrito photoisomerization: crystal structures of trans-bis­(acetyl­acetonato-O,O′)(pyridine/4-methyl­pyridine/3-hy­droxy­pridine)nitro­cobalt(III)
title_sort investigation of nitro–nitrito photoisomerization: crystal structures of trans-bis­(acetyl­acetonato-o,o′)(pyridine/4-methyl­pyridine/3-hy­droxy­pridine)nitro­cobalt(iii)
topic Research Communications
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6218901/
https://www.ncbi.nlm.nih.gov/pubmed/30443397
http://dx.doi.org/10.1107/S2056989018014731
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