Organic–Inorganic Manganese (II) Halide Hybrid Combining the Two Isomers Cis/Trans of [MnCl<sub>4</sub>(H<sub>2</sub>O)<sub>2</sub>]: Crystal Structure, Physical Properties, Pharmacokinetics and Biological Evaluation

A manganese (II) complex templated by hexahydro-1,4-diazepinediium as a counter ion was grown by slow evaporation from an aqueous solution at room temperature. The X-ray diffraction analysis revealed that the compound (C<sub>5</sub>H<sub>14</sub>N<sub>2</sub>)[MnC...

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Main Authors: Mansoura Bourwina, Sandra Walha, Najeh Krayem, Riadh Badraoui, Faten Brahmi, Wejdan M. Alshammari, Mejdi Snoussi, Mark M. Turnbull, Thierry Roisnel, Houcine Naïli
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Language:English
Published: MDPI AG 2023-02-01
Series:Inorganics
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Online Access:https://www.mdpi.com/2304-6740/11/2/76
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author Mansoura Bourwina
Sandra Walha
Najeh Krayem
Riadh Badraoui
Faten Brahmi
Wejdan M. Alshammari
Mejdi Snoussi
Mark M. Turnbull
Thierry Roisnel
Houcine Naïli
author_facet Mansoura Bourwina
Sandra Walha
Najeh Krayem
Riadh Badraoui
Faten Brahmi
Wejdan M. Alshammari
Mejdi Snoussi
Mark M. Turnbull
Thierry Roisnel
Houcine Naïli
author_sort Mansoura Bourwina
collection DOAJ
description A manganese (II) complex templated by hexahydro-1,4-diazepinediium as a counter ion was grown by slow evaporation from an aqueous solution at room temperature. The X-ray diffraction analysis revealed that the compound (C<sub>5</sub>H<sub>14</sub>N<sub>2</sub>)[MnCl<sub>4</sub>(H<sub>2</sub>O)<sub>2</sub>] crystallizes in the centrosymmetric space group P2/c of the monoclinic system. The crystal structure of the Mn(II) complex is characterized by an alternation of 0-dimensional organic and inorganic stacks linked together by N/O-H…Cl and N-H…O hydrogen bonds, which lead to a three-dimensional supramolecular architecture. In this structure, the inorganic layer is built up by independent anionic moieties combining the two isomers cis/trans of [MnCl<sub>4</sub>(H<sub>2</sub>O)<sub>2</sub>]<sup>2−</sup>. The thermal decomposition was studied by TGA-DTA techniques. The optical band gap and Urbach energy were obtained by Tauc’s equation. The direct and indirect band gap values are found to be 4.58 and 4.44 eV, respectively. Weak antiferromagnetic interactions are present in the molecule under study, according to magnetic measurements. An agar well diffusion technique was used to assess the synthetic compound’s biological activity, and the results showed that it has potent antibacterial (Gram-positive and Gram-negative) properties. Interestingly, the synthesized compound also displayed antilipase activity. These biological activities have been confirmed by the bioavailability and pharmacokinetic analyses.
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spelling doaj.art-dce95e944f6c445bb3db9c1a60a615122023-11-16T21:13:36ZengMDPI AGInorganics2304-67402023-02-011127610.3390/inorganics11020076Organic–Inorganic Manganese (II) Halide Hybrid Combining the Two Isomers Cis/Trans of [MnCl<sub>4</sub>(H<sub>2</sub>O)<sub>2</sub>]: Crystal Structure, Physical Properties, Pharmacokinetics and Biological EvaluationMansoura Bourwina0Sandra Walha1Najeh Krayem2Riadh Badraoui3Faten Brahmi4Wejdan M. Alshammari5Mejdi Snoussi6Mark M. Turnbull7Thierry Roisnel8Houcine Naïli9Laboratoire Physico-Chimie de l’Etat Solide, Département de Chimie, Faculté des Sciences de Sfax, Université de Sfax, B.P. 1171, Sfax 3000, TunisiaLaboratoire Physico-Chimie de l’Etat Solide, Département de Chimie, Faculté des Sciences de Sfax, Université de Sfax, B.P. 1171, Sfax 3000, TunisiaLaboratory of Biochemistry and Engineering of Lipases, National School of Engineering of Sfax (ENIS), University of Sfax, Sfax 3000, TunisiaLaboratory of General Biology, Department of Biology, University of Ha’il, Ha’il 81451, Saudi ArabiaLaboratory of Organic Chemistry, Department of Chemistry, University of Ha’il, Ha’il 81451, Saudi ArabiaLaboratory of General Biology, Department of Biology, University of Ha’il, Ha’il 81451, Saudi ArabiaLaboratory of General Biology, Department of Biology, University of Ha’il, Ha’il 81451, Saudi ArabiaCarlson School of Chemistry and Biochemistry, Clark University, Worcester, MA 01610, USAInstitut des Sciences Chimiques de Rennes, UMR 6226 CNRS, Campus de Beaulieu France, Université Rennes, F-35000 Rennes, FranceLaboratoire Physico-Chimie de l’Etat Solide, Département de Chimie, Faculté des Sciences de Sfax, Université de Sfax, B.P. 1171, Sfax 3000, TunisiaA manganese (II) complex templated by hexahydro-1,4-diazepinediium as a counter ion was grown by slow evaporation from an aqueous solution at room temperature. The X-ray diffraction analysis revealed that the compound (C<sub>5</sub>H<sub>14</sub>N<sub>2</sub>)[MnCl<sub>4</sub>(H<sub>2</sub>O)<sub>2</sub>] crystallizes in the centrosymmetric space group P2/c of the monoclinic system. The crystal structure of the Mn(II) complex is characterized by an alternation of 0-dimensional organic and inorganic stacks linked together by N/O-H…Cl and N-H…O hydrogen bonds, which lead to a three-dimensional supramolecular architecture. In this structure, the inorganic layer is built up by independent anionic moieties combining the two isomers cis/trans of [MnCl<sub>4</sub>(H<sub>2</sub>O)<sub>2</sub>]<sup>2−</sup>. The thermal decomposition was studied by TGA-DTA techniques. The optical band gap and Urbach energy were obtained by Tauc’s equation. The direct and indirect band gap values are found to be 4.58 and 4.44 eV, respectively. Weak antiferromagnetic interactions are present in the molecule under study, according to magnetic measurements. An agar well diffusion technique was used to assess the synthetic compound’s biological activity, and the results showed that it has potent antibacterial (Gram-positive and Gram-negative) properties. Interestingly, the synthesized compound also displayed antilipase activity. These biological activities have been confirmed by the bioavailability and pharmacokinetic analyses.https://www.mdpi.com/2304-6740/11/2/76manganese (II) complexthermal analysisinfrared spectroscopyoptical band gapmagnetic propertiespharmacokinetics
spellingShingle Mansoura Bourwina
Sandra Walha
Najeh Krayem
Riadh Badraoui
Faten Brahmi
Wejdan M. Alshammari
Mejdi Snoussi
Mark M. Turnbull
Thierry Roisnel
Houcine Naïli
Organic–Inorganic Manganese (II) Halide Hybrid Combining the Two Isomers Cis/Trans of [MnCl<sub>4</sub>(H<sub>2</sub>O)<sub>2</sub>]: Crystal Structure, Physical Properties, Pharmacokinetics and Biological Evaluation
Inorganics
manganese (II) complex
thermal analysis
infrared spectroscopy
optical band gap
magnetic properties
pharmacokinetics
title Organic–Inorganic Manganese (II) Halide Hybrid Combining the Two Isomers Cis/Trans of [MnCl<sub>4</sub>(H<sub>2</sub>O)<sub>2</sub>]: Crystal Structure, Physical Properties, Pharmacokinetics and Biological Evaluation
title_full Organic–Inorganic Manganese (II) Halide Hybrid Combining the Two Isomers Cis/Trans of [MnCl<sub>4</sub>(H<sub>2</sub>O)<sub>2</sub>]: Crystal Structure, Physical Properties, Pharmacokinetics and Biological Evaluation
title_fullStr Organic–Inorganic Manganese (II) Halide Hybrid Combining the Two Isomers Cis/Trans of [MnCl<sub>4</sub>(H<sub>2</sub>O)<sub>2</sub>]: Crystal Structure, Physical Properties, Pharmacokinetics and Biological Evaluation
title_full_unstemmed Organic–Inorganic Manganese (II) Halide Hybrid Combining the Two Isomers Cis/Trans of [MnCl<sub>4</sub>(H<sub>2</sub>O)<sub>2</sub>]: Crystal Structure, Physical Properties, Pharmacokinetics and Biological Evaluation
title_short Organic–Inorganic Manganese (II) Halide Hybrid Combining the Two Isomers Cis/Trans of [MnCl<sub>4</sub>(H<sub>2</sub>O)<sub>2</sub>]: Crystal Structure, Physical Properties, Pharmacokinetics and Biological Evaluation
title_sort organic inorganic manganese ii halide hybrid combining the two isomers cis trans of mncl sub 4 sub h sub 2 sub o sub 2 sub crystal structure physical properties pharmacokinetics and biological evaluation
topic manganese (II) complex
thermal analysis
infrared spectroscopy
optical band gap
magnetic properties
pharmacokinetics
url https://www.mdpi.com/2304-6740/11/2/76
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