Crystal structure of <i>catena</i> -poly[[tetraaquamanganese(II)]-μ-1,5-dihydroxynaphthalene-2,6-dicarboxylato]

The title compound, [Mn(H<sub>2</sub>dondc)(H<sub>2</sub>O)<sub>4</sub>] <sub><i>n</i></sub> or [Mn(C<sub>12</sub>H<sub>6</sub>O<sub>6</sub>)(H<sub>2</sub>O)<sub>4</sub>] <sub><i>n</i></sub> , was synthesized by the reaction of manganese(II) chloride (MnCl<sub>2</sub>), 1,5-dihy-droxynaphthalene-2,6-di-carb-oxy-lic acid (H<sub>4</sub>dondc) and lithium hydroxide (LiOH). The asymmetric unit comprises half of an Mn<sup>II</sup> ion, half of a 1,5-dihy-droxynaphthalene-2,6-di-carboxyl-ate dianion (H<sub>2</sub>dondc<sup>2-</sup>) and two water mol-ecules. The Mn<sup>II</sup> ion is located on a crystallographic inversion center and exhibits a six-coordinated MnO<sub>6</sub> octa-hedral geometry. The octa-hedron is comprised of two oxygen atoms from the two H<sub>2</sub>dondc<sup>2-</sup> ligands and four oxygen atoms from the water mol-ecules. The carboxyl-ate group and naphthalene moiety lie almost coplanar to each other and show a monodentate coordination to the Mn<sup>II</sup> ion. The planar H<sub>2</sub>dondc<sup>2-</sup> ligands bridge Mn<sup>II</sup> ions to form a one-dimensional chain along the diagonal direction of the <i>b</i> and <i>c</i> axes. In the crystal, there are two types of intra-chain hydrogen-bonding inter-actions. The first is between the phenolic hydroxyl groups and carboxyl-ate groups. The phenolic hydroxyl groups of the ligand are protonated and act as intra-chain hydrogen-bonding donors to coordinated oxygen atoms of the carboxyl-ate groups. The other is between coordinated water mol-ecules and non-coordinated oxygen atoms of the carboxyl-ate groups. The parallel chains are connected not only by inter-chain hydrogen-bonding inter-actions between coordinated water mol-ecules and phenolic hydroxyl groups but also by inter-chain hydrogen-bonding inter-actions between coordinated water mol-ecules to give two-dimensional networks. The chains are further connected by inter-chain π-π stacking inter-actions between the naphthalene moieties.

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Journal
Acta Crystallographica Section E Crystallographic Communications
Published
2026-01-15
DOI
https://doi.org/10.1107/s205698902600040x
Primary Topic
Crystal structures of chemical compounds
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article
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article

Crystal structure of catena -poly[[tetraaquamanganese(II)]-μ-1,5-dihydroxynaphthalene-2,6-dicarboxylato]

Hitoshi Kumagai, Nobuhiro Ogihara
Acta Crystallographica Section E Crystallographic Communications
Crystal structures of chemical compounds
article

Crystal structure of catena -poly[[tetraaquamanganese(II)]-μ-1,5-dihydroxynaphthalene-2,6-dicarboxylato]

Hitoshi Kumagai, Nobuhiro Ogihara
article en

Abstract

The title compound, [Mn(H<sub>2</sub>dondc)(H<sub>2</sub>O)<sub>4</sub>] <sub><i>n</i></sub> or [Mn(C<sub>12</sub>H<sub>6</sub>O<sub>6</sub>)(H<sub>2</sub>O)<sub>4</sub>] <sub><i>n</i></sub> , was synthesized by the reaction of manganese(II) chloride (MnCl<sub>2</sub>), 1,5-dihy-droxynaphthalene-2,6-di-carb-oxy-lic acid (H<sub>4</sub>dondc) and lithium hydroxide (LiOH). The asymmetric unit comprises half of an Mn<sup>II</sup> ion, half of a 1,5-dihy-droxynaphthalene-2,6-di-carboxyl-ate dianion (H<sub>2</sub>dondc<sup>2-</sup>) and two water mol-ecules. The Mn<sup>II</sup> ion is located on a crystallographic inversion center and exhibits a six-coordinated MnO<sub>6</sub> octa-hedral geometry. The octa-hedron is comprised of two oxygen atoms from the two H<sub>2</sub>dondc<sup>2-</sup> ligands and four oxygen atoms from the water mol-ecules. The carboxyl-ate group and naphthalene moiety lie almost coplanar to each other and show a monodentate coordination to the Mn<sup>II</sup> ion. The planar H<sub>2</sub>dondc<sup>2-</sup> ligands bridge Mn<sup>II</sup> ions to form a one-dimensional chain along the diagonal direction of the <i>b</i> and <i>c</i> axes. In the crystal, there are two types of intra-chain hydrogen-bonding inter-actions. The first is between the phenolic hydroxyl groups and carboxyl-ate groups. The phenolic hydroxyl groups of the ligand are protonated and act as intra-chain hydrogen-bonding donors to coordinated oxygen atoms of the carboxyl-ate groups. The other is between coordinated water mol-ecules and non-coordinated oxygen atoms of the carboxyl-ate groups. The parallel chains are connected not only by inter-chain hydrogen-bonding inter-actions between coordinated water mol-ecules and phenolic hydroxyl groups but also by inter-chain hydrogen-bonding inter-actions between coordinated water mol-ecules to give two-dimensional networks. The chains are further connected by inter-chain π-π stacking inter-actions between the naphthalene moieties.

Acta Crystallographica Section E Crystallographic CommunicationsVol. 82(2)
Toyota Central Research and Development Laboratories (Japan) (JP)
Openalex Percentile: Top 84%
Crystal structures of chemical compounds
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