Literature DB >> 35145735

4-[(Benzyl-amino)-carbon-yl]-1-methyl-pyridinium halogenide salts: X-ray diffraction study and Hirshfeld surface analysis.

Svitlana V Shishkina1,2, Anna M Shaposhnik1, Vyacheslav M Baumer1, Vitalii V Rudiuk3, Igor A Levandovskiy4.   

Abstract

Two salts of 4-[(benzyl-amino)-carbon-yl]-1-methyl-pyridinium (Am) with chloride (C14H15N2O+·Cl-) and bromide (C14H15N2O+·Br-) anions were studied and compared with the iodide salt. AmCl crystallizes in the centrosymmetric space group P21/n while AmBr and AmI form crystals in the Sohncke space group P212121. Crystals of AmBr are isostructural to those of AmI. The cation and anion are bound by an N-H⋯Hal hydrogen bond. Hirshfeld surface analysis was used to compare different types of inter-molecular inter-actions in the three structures under study. © Shishkina et al. 2022.

Entities:  

Keywords:  4-[(benzyl­amino)­carbon­yl]-1-methyl­pyridinium; Hirshfeld surface analysis; crystal structure; mol­ecular structure

Year:  2022        PMID: 35145735      PMCID: PMC8819432          DOI: 10.1107/S2056989021013505

Source DB:  PubMed          Journal:  Acta Crystallogr E Crystallogr Commun


  12 in total

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