Single crystal X-ray structural dataset of 1,2,4-dithiazolium tetrafluoroborate

: Prakasam Balasubramaniam Arul, Kumar Chandran Udhaya, Lahtinen Manu, Peuronen Anssi, Sillanpää Mika

Publisher: Elsevier BV

: 2022

: Data in Brief

: 107924

: 41

DOI: https://doi.org/10.1016/j.dib.2022.107924

: https://doi.org/10.1016/j.dib.2022.107924

: https://research.utu.fi/converis/portal/detail/Publication/73958780

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 R 2 2 ( 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.

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