Cargando…

Di-μ-benzoato-di-μ-ethano­lato-tetra­kis­[μ(3)-5-(hy­droxy­meth­yl)-2-methyl-4-(oxidometh­yl)pyridin-1-ium-3-olato]tetra­kis­[μ(3)-5-(hy­droxy­meth­yl)-2-methyl-4-(oxidometh­yl)pyridin-3-olato]di-μ(3)-oxido-hepta­manganese(II,III) ethanol octa­solvate

Our work in the area of synthesis of polynuclear manganese complexes and their magnetic properties led to the synthesis and crystallization of the title compound, [Mn(7)(C(8)H(9)NO(3))(4)(C(8)H(10)NO(3))(4)(C(2)H(5)O)(2)(C(7)H(5)O(2))(2)O(2)]·8C(2)H(5)OH. Herein, we report the molecular and crystal...

Descripción completa

Detalles Bibliográficos
Autores principales: Saha, Arpita, Padgett, Clifford W., LeMagueres, Pierre, Moncur, Kiana, Onajobi, Glory
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2021
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9462263/
https://www.ncbi.nlm.nih.gov/pubmed/36340470
http://dx.doi.org/10.1107/S2414314620016430
_version_ 1784787145279406080
author Saha, Arpita
Padgett, Clifford W.
LeMagueres, Pierre
Moncur, Kiana
Onajobi, Glory
author_facet Saha, Arpita
Padgett, Clifford W.
LeMagueres, Pierre
Moncur, Kiana
Onajobi, Glory
author_sort Saha, Arpita
collection PubMed
description Our work in the area of synthesis of polynuclear manganese complexes and their magnetic properties led to the synthesis and crystallization of the title compound, [Mn(7)(C(8)H(9)NO(3))(4)(C(8)H(10)NO(3))(4)(C(2)H(5)O)(2)(C(7)H(5)O(2))(2)O(2)]·8C(2)H(5)OH. Herein, we report the molecular and crystal structure of the title compound, which was synthesized by the reaction of Mn(C(6)H(5)COO)(2) with pyridoxine (PNH(2), C(8)H(11)NO(3)) followed by the addition of tetra­methyl­ammonium hydroxide (TMAOH). The core of this centrosymmetric complex is a cage-like structure consisting of six Mn(III) ions and one Mn(II) ion bound together through Mn—O bonds. The compound crystallizes in hydrogen-bonded layers formed by O—H⋯N hydrogen bonds involving the aromatic amine group of the ligand PN(2−) with the neighboring O atoms from the PNH(−) ligand. The crystal structure has large voids present in which highly disordered solvent mol­ecules (ethanol) sit. A solvent mask was calculated and 181 electrons were found in a volume of 843 Å(3) in one void per triclinic unit cell. This is consistent with the presence of seven ethanol mol­ecules per formula unit, which accounts for 182 electrons per unit cell. Additionally, one ethanol mol­ecule was found to be ordered in the crystal. [Image: see text]
format Online
Article
Text
id pubmed-9462263
institution National Center for Biotechnology Information
language English
publishDate 2021
publisher International Union of Crystallography
record_format MEDLINE/PubMed
spelling pubmed-94622632022-11-04 Di-μ-benzoato-di-μ-ethano­lato-tetra­kis­[μ(3)-5-(hy­droxy­meth­yl)-2-methyl-4-(oxidometh­yl)pyridin-1-ium-3-olato]tetra­kis­[μ(3)-5-(hy­droxy­meth­yl)-2-methyl-4-(oxidometh­yl)pyridin-3-olato]di-μ(3)-oxido-hepta­manganese(II,III) ethanol octa­solvate Saha, Arpita Padgett, Clifford W. LeMagueres, Pierre Moncur, Kiana Onajobi, Glory IUCrdata Data Reports Our work in the area of synthesis of polynuclear manganese complexes and their magnetic properties led to the synthesis and crystallization of the title compound, [Mn(7)(C(8)H(9)NO(3))(4)(C(8)H(10)NO(3))(4)(C(2)H(5)O)(2)(C(7)H(5)O(2))(2)O(2)]·8C(2)H(5)OH. Herein, we report the molecular and crystal structure of the title compound, which was synthesized by the reaction of Mn(C(6)H(5)COO)(2) with pyridoxine (PNH(2), C(8)H(11)NO(3)) followed by the addition of tetra­methyl­ammonium hydroxide (TMAOH). The core of this centrosymmetric complex is a cage-like structure consisting of six Mn(III) ions and one Mn(II) ion bound together through Mn—O bonds. The compound crystallizes in hydrogen-bonded layers formed by O—H⋯N hydrogen bonds involving the aromatic amine group of the ligand PN(2−) with the neighboring O atoms from the PNH(−) ligand. The crystal structure has large voids present in which highly disordered solvent mol­ecules (ethanol) sit. A solvent mask was calculated and 181 electrons were found in a volume of 843 Å(3) in one void per triclinic unit cell. This is consistent with the presence of seven ethanol mol­ecules per formula unit, which accounts for 182 electrons per unit cell. Additionally, one ethanol mol­ecule was found to be ordered in the crystal. [Image: see text] International Union of Crystallography 2021-01-05 /pmc/articles/PMC9462263/ /pubmed/36340470 http://dx.doi.org/10.1107/S2414314620016430 Text en © Saha et al. 2021 https://creativecommons.org/licenses/by/4.0/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.
spellingShingle Data Reports
Saha, Arpita
Padgett, Clifford W.
LeMagueres, Pierre
Moncur, Kiana
Onajobi, Glory
Di-μ-benzoato-di-μ-ethano­lato-tetra­kis­[μ(3)-5-(hy­droxy­meth­yl)-2-methyl-4-(oxidometh­yl)pyridin-1-ium-3-olato]tetra­kis­[μ(3)-5-(hy­droxy­meth­yl)-2-methyl-4-(oxidometh­yl)pyridin-3-olato]di-μ(3)-oxido-hepta­manganese(II,III) ethanol octa­solvate
title Di-μ-benzoato-di-μ-ethano­lato-tetra­kis­[μ(3)-5-(hy­droxy­meth­yl)-2-methyl-4-(oxidometh­yl)pyridin-1-ium-3-olato]tetra­kis­[μ(3)-5-(hy­droxy­meth­yl)-2-methyl-4-(oxidometh­yl)pyridin-3-olato]di-μ(3)-oxido-hepta­manganese(II,III) ethanol octa­solvate
title_full Di-μ-benzoato-di-μ-ethano­lato-tetra­kis­[μ(3)-5-(hy­droxy­meth­yl)-2-methyl-4-(oxidometh­yl)pyridin-1-ium-3-olato]tetra­kis­[μ(3)-5-(hy­droxy­meth­yl)-2-methyl-4-(oxidometh­yl)pyridin-3-olato]di-μ(3)-oxido-hepta­manganese(II,III) ethanol octa­solvate
title_fullStr Di-μ-benzoato-di-μ-ethano­lato-tetra­kis­[μ(3)-5-(hy­droxy­meth­yl)-2-methyl-4-(oxidometh­yl)pyridin-1-ium-3-olato]tetra­kis­[μ(3)-5-(hy­droxy­meth­yl)-2-methyl-4-(oxidometh­yl)pyridin-3-olato]di-μ(3)-oxido-hepta­manganese(II,III) ethanol octa­solvate
title_full_unstemmed Di-μ-benzoato-di-μ-ethano­lato-tetra­kis­[μ(3)-5-(hy­droxy­meth­yl)-2-methyl-4-(oxidometh­yl)pyridin-1-ium-3-olato]tetra­kis­[μ(3)-5-(hy­droxy­meth­yl)-2-methyl-4-(oxidometh­yl)pyridin-3-olato]di-μ(3)-oxido-hepta­manganese(II,III) ethanol octa­solvate
title_short Di-μ-benzoato-di-μ-ethano­lato-tetra­kis­[μ(3)-5-(hy­droxy­meth­yl)-2-methyl-4-(oxidometh­yl)pyridin-1-ium-3-olato]tetra­kis­[μ(3)-5-(hy­droxy­meth­yl)-2-methyl-4-(oxidometh­yl)pyridin-3-olato]di-μ(3)-oxido-hepta­manganese(II,III) ethanol octa­solvate
title_sort di-μ-benzoato-di-μ-ethano­lato-tetra­kis­[μ(3)-5-(hy­droxy­meth­yl)-2-methyl-4-(oxidometh­yl)pyridin-1-ium-3-olato]tetra­kis­[μ(3)-5-(hy­droxy­meth­yl)-2-methyl-4-(oxidometh­yl)pyridin-3-olato]di-μ(3)-oxido-hepta­manganese(ii,iii) ethanol octa­solvate
topic Data Reports
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9462263/
https://www.ncbi.nlm.nih.gov/pubmed/36340470
http://dx.doi.org/10.1107/S2414314620016430
work_keys_str_mv AT sahaarpita dimbenzoatodimethanolatotetrakism35hydroxymethyl2methyl4oxidomethylpyridin1ium3olatotetrakism35hydroxymethyl2methyl4oxidomethylpyridin3olatodim3oxidoheptamanganeseiiiiiethanoloctasolvate
AT padgettcliffordw dimbenzoatodimethanolatotetrakism35hydroxymethyl2methyl4oxidomethylpyridin1ium3olatotetrakism35hydroxymethyl2methyl4oxidomethylpyridin3olatodim3oxidoheptamanganeseiiiiiethanoloctasolvate
AT lemaguerespierre dimbenzoatodimethanolatotetrakism35hydroxymethyl2methyl4oxidomethylpyridin1ium3olatotetrakism35hydroxymethyl2methyl4oxidomethylpyridin3olatodim3oxidoheptamanganeseiiiiiethanoloctasolvate
AT moncurkiana dimbenzoatodimethanolatotetrakism35hydroxymethyl2methyl4oxidomethylpyridin1ium3olatotetrakism35hydroxymethyl2methyl4oxidomethylpyridin3olatodim3oxidoheptamanganeseiiiiiethanoloctasolvate
AT onajobiglory dimbenzoatodimethanolatotetrakism35hydroxymethyl2methyl4oxidomethylpyridin1ium3olatotetrakism35hydroxymethyl2methyl4oxidomethylpyridin3olatodim3oxidoheptamanganeseiiiiiethanoloctasolvate