Single crystal X-ray structural dataset of 1,2,4-dithiazolium tetrafluoroborate
Balasubramaniam Arul Prakasam,
Chandran Udhaya Kumar,
Manu Lahtinen,
Anssi Peuronen,
Mika Sillanpää
Affiliations
Balasubramaniam Arul Prakasam
Department of Chemistry, Annamalai University, Annamalainagar, 608002, India; Corresponding authors.
Chandran Udhaya Kumar
Department of Chemistry, Annamalai University, Annamalainagar, 608002, India
Manu Lahtinen
Department of Chemistry, P.O.Box 35, FI-40014 University of Jyväskylä, Jyväskylä, Finland; Corresponding authors.
Anssi Peuronen
Group of Intelligent Materials Chemistry, Department of Chemistry, University of Turku, FI-20014 Turku, Finland
Mika Sillanpää
Department of Chemical Engineering, School of Mining, Metallurgy and Chemical Engineering, University of Johannesburg, P. O. Box 17011, Doornfontein 2028, South Africa; Chemistry Department, College of Science, King Saud University, Riyadh 11451, Saudi Arabia; Faculty of Science and Technology, School of Applied Physics, University Kebangsaan Malaysia, 43600 Bangi, Selangor, Malaysia; Department of Biological and Chemical Engineering, Aarhus University, Nørrebrogade 44, 8000 Aarhus C, Denmark
Herein, we present the crystallographic dataset of 1,2,4-dithiazolium tetrafluoroborate. Single crystal X-ray structural analysis evidences that the 1,2,4-dithiazolium ring is almost planar. The 1,2,4-dithiazolium and tetrafluoroborate ions contribute in hydrogen bonding wherein the N-H·N hydrogen bonding in 1,2,4-dithiazolium dimer forms an eight-membered pseudo ring with the R22(8) Etter's graph set. The information provided in this data contributes to the understanding of structural chemistry and hydrogen bonding interactions in dithiazole derivatives.
