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

Creative Commons License

ŞEN P., Kansiz S., DEGE N., Yildiz S. Z., Tsapyuk G. G.

ACTA CRYSTALLOGRAPHICA SECTION E-CRYSTALLOGRAPHIC COMMUNICATIONS, cilt.74, ss.1517-1528, 2018 (ESCI) identifier identifier identifier

  • 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: Emerging Sources Citation Index (ESCI), Scopus
  • Sayfa Sayıları: ss.1517-1528
  • Anahtar Kelimeler: crystal structure, imidazol, ethanaminium, ethanaminium chloride, Hirshfeld surface, COMPLEXES
  • Ondokuz Mayıs Üniversitesi Adresli: Evet

Özet

The asymmetric unit of the title compound, C8H11N32+ center dot 2Cl(- )center dot H2O, contains three organic cations, six chloride anions and three water molecules of crystallization, which are connected by extensive hydrogen-bonding interactions into a threedimensional supramolecular architecture. Hirshfeld surface analysis and two-dimensional fingerprint plots indicate that the most important contributions to the crystal packing are from H center dot center dot center dot H (37.4%), Cl center dot center dot center dot H/H center dot center dot center dot Cl (35.5%), C center dot center dot center dot H/H center dot center dot center dot C (9.5%) and C center dot center dot center dot C (6.9%) interactions.