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Synthesis, crystal structure, and Hirshfeld surface analysis of 1,3-di-hydro-2-benzimidazol-2-iminium 3-carb-oxy-4-hy-droxy-benzene-sulfonate. | LitMetric

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Article Abstract

The asymmetric unit of the title salt, CHN ·CHOS, comprises two 1,3-di-hydro-2-benzimidazol-2-iminium cations and two 2-hy-droxy-5-sulfobenzoate anions (' = 2). In the crystal, the mol-ecules inter-act through N-H⋯O, O-H⋯O hydrogen bonds and C-O⋯π contacts. The hydrogen-bonding inter-actions lead to the formation of layers parallel to (01). Hirshfeld surface analysis revealed that H⋯H contacts contribute to most of the crystal packing with 38.9%, followed by H⋯O contacts with 36.2%.

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Source
http://www.ncbi.nlm.nih.gov/pmc/articles/PMC11451492PMC
http://dx.doi.org/10.1107/S2056989024008557DOI Listing

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