Synthesis and structure of tris(2-methyl-1<i>H</i>-imidazol-3-ium) 5-carboxybenzene-1,3-dicarboxylate 3,5-dicarboxybenzoate

The structure of the title salt, 3C<sub>4</sub>H<sub>7</sub>N<sub>2</sub> <sup>+</sup>·C<sub>9</sub>H<sub>5</sub>O<sub>6</sub> <sup>-</sup>·C<sub>9</sub>H<sub>4</sub>O<sub>6</sub> <sup>2-</sup>, <b>1</b>, consists of three 2-methyl-imidazolium cations and both a single and a doubly deprotonated form of trimesic acid as anions. A detailed analysis of the bond lengths and angles reveals both differences and similarities between compound <b>1</b> and the previously reported 2-methyl-1<i>H</i>-imidazol-3-ium 3,5-di-carb-oxy-benzoate structure [Baletska <i>et a</i>l. (2023). <i>Acta Cryst.</i> E<b>79</b>, 1088-109], as well as the neutral counterpart of the ions. Examination of the crystal packing shows the formation of infinite chains by the anions, which, along with the cations, form zigzag planes parallel to the <i>ab</i> plane. The packing inter-actions are primarily driven by π-π inter-actions and hydrogen bonding between anions.

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Journal
Acta Crystallographica Section E Crystallographic Communications
Published
2025-03-11
DOI
https://doi.org/10.1107/s2056989025002063
Citations
1
Primary Topic
Crystal structures of chemical compounds
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article
Field-Weighted Citation Impact
0.54
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article

Synthesis and structure of tris(2-methyl-1H-imidazol-3-ium) 5-carboxybenzene-1,3-dicarboxylate 3,5-dicarboxybenzoate

Simone Techert, José de Jesús Velazquez-Garcia, Lina Maria Asprilla-Herrera
1 citations
Acta Crystallographica Section E Crystallographic Communications
Crystal structures of chemical compounds
0.54
article

Synthesis and structure of tris(2-methyl-1H-imidazol-3-ium) 5-carboxybenzene-1,3-dicarboxylate 3,5-dicarboxybenzoate

Simone Techert, José de Jesús Velazquez-Garcia, Lina Maria Asprilla-Herrera
article en
1 citations

Abstract

The structure of the title salt, 3C<sub>4</sub>H<sub>7</sub>N<sub>2</sub> <sup>+</sup>·C<sub>9</sub>H<sub>5</sub>O<sub>6</sub> <sup>-</sup>·C<sub>9</sub>H<sub>4</sub>O<sub>6</sub> <sup>2-</sup>, <b>1</b>, consists of three 2-methyl-imidazolium cations and both a single and a doubly deprotonated form of trimesic acid as anions. A detailed analysis of the bond lengths and angles reveals both differences and similarities between compound <b>1</b> and the previously reported 2-methyl-1<i>H</i>-imidazol-3-ium 3,5-di-carb-oxy-benzoate structure [Baletska <i>et a</i>l. (2023). <i>Acta Cryst.</i> E<b>79</b>, 1088-109], as well as the neutral counterpart of the ions. Examination of the crystal packing shows the formation of infinite chains by the anions, which, along with the cations, form zigzag planes parallel to the <i>ab</i> plane. The packing inter-actions are primarily driven by π-π inter-actions and hydrogen bonding between anions.

Acta Crystallographica Section E Crystallographic CommunicationsVol. 81(4)
Deutsches Elektronen-Synchrotron DESY (DE), University of Göttingen (DE), Universidad del Valle (CO)
Life below water
Openalex Percentile: Top 39%
Crystal structures of chemical compounds
0.54
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