Crystal structure and Hirshfeld surface analysis and of 2-ammoniumylmethyl-1 H -benzimidazol-3-ium chloride monohydrate

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Sen P., KANSIZ S., Dege N., Yildiz S. Z., Tsapyuk G. G.

Acta Crystallographica Section E: Crystallographic Communications, cilt.74, ss.1517-1520, 2018 (Scopus)

• Yayın Türü: Makale / Tam Makale
• Cilt numarası: 74
• Basım Tarihi: 2018
• Doi Numarası: 10.1107/s205698901801335x
• Dergi Adı: Acta Crystallographica Section E: Crystallographic Communications
• Derginin Tarandığı İndeksler: Scopus
• Sayfa Sayıları: ss.1517-1520
• Anahtar Kelimeler: crystal structure, ethanaminium, ethanaminium chloride, Hirshfeld surface, imidazol
• Samsun Üniversitesi Adresli: Hayır

Özet

The asymmetric unit of the title compound, C 8 H 11 N 3 2+ ·2Cl - ·H 2 O, contains three organic cations, six chloride anions and three water molecules of crystallization, which are connected by extensive hydrogen-bonding interactions into a three-dimensional supramolecular architecture. Hirshfeld surface analysis and two-dimensional fingerprint plots indicate that the most important contributions to the crystal packing are from H⋯H (37.4%), Cl⋯H/H⋯Cl (35.5%), C⋯H/H⋯C (9.5%) and C⋯C (6.9%) interactions.