Crystal structure and Hirshfeld surface analysis of ketorolac tromethamine

Ketorolac tromethamine or 1,3-dihy-droxy-2-(hy-droxy-meth-yl)propan-2-am-inium 5-benzoyl-2,3-di-hydro-1<i>H</i>-pyrrolizine-1-carboxyl-ate, C<sub>15</sub>H<sub>12</sub>NO<sub>3</sub> <sup>+</sup>·C<sub>4</sub>H<sub>12</sub>NO<sub>3</sub> <sup>-</sup>, was studied by single-crystal and powder X-ray diffraction methods. One cation and one anion are present in the asymmetric unit. In the crystal, N-H⋯O and O-H⋯O hy-dro-gen bonds link the cation and anion. All the hy-dro-gen-bond inter-actions result in the formation of a di-periodic layer in the (100) crystallographic plane.

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Publication Details

Journal
Acta Crystallographica Section E Crystallographic Communications
Published
2025-04-24
DOI
https://doi.org/10.1107/s2056989025003226
Primary Topic
Synthesis and Catalytic Reactions
Type
article
Field-Weighted Citation Impact
0.00

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article

Crystal structure and Hirshfeld surface analysis of ketorolac tromethamine

Anna N. Puzan, В.Н. Баумер, Vitalii V. Rudiuk
Acta Crystallographica Section E Crystallographic Communications
Synthesis and Catalytic Reactions
article

Crystal structure and Hirshfeld surface analysis of ketorolac tromethamine

Anna N. Puzan, В.Н. Баумер, Vitalii V. Rudiuk
article en

Abstract

Ketorolac tromethamine or 1,3-dihy-droxy-2-(hy-droxy-meth-yl)propan-2-am-inium 5-benzoyl-2,3-di-hydro-1<i>H</i>-pyrrolizine-1-carboxyl-ate, C<sub>15</sub>H<sub>12</sub>NO<sub>3</sub> <sup>+</sup>·C<sub>4</sub>H<sub>12</sub>NO<sub>3</sub> <sup>-</sup>, was studied by single-crystal and powder X-ray diffraction methods. One cation and one anion are present in the asymmetric unit. In the crystal, N-H⋯O and O-H⋯O hy-dro-gen bonds link the cation and anion. All the hy-dro-gen-bond inter-actions result in the formation of a di-periodic layer in the (100) crystallographic plane.

Acta Crystallographica Section E Crystallographic CommunicationsVol. 81(5)
State Scientific Institution “Institute for Single Crystals” of National Academy of Sciences of Ukraine (UA)
National Academy of Sciences of Ukraine
Openalex Percentile: Top 93%
Synthesis and Catalytic Reactions
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