Crystal structure and Hirshfeld surface analysis of 3-amino-5-phenylthiazolidin-2-iminium bromide

Acta Crystallographica Section E: Crystallographic Communications

Mehmet Akkurt¹  Taras Chyrka²  Gunay Z. Mammadova³  Gulnara Sh. Duruskari³  Abel M. Maharramov³  Ali N. Khalilov³ 

[1] Department of Physics, Faculty of Sciences, Erciyes University, 38039 Kayseri, Turkey;Department of Theoretical and Industrial Heat Engineering (TPT), National Technical University of Ukraine, "Igor Sikorsky Kyiv Polytechnic Institute", 03056, Kyiv, Ukraine;Organic Chemistry Department, Baku State University, Z. Xalilov str. 23, Az, 1148 Baku, Azerbaijan;

关键词: crystal structure;    charge-assisted hydrogen bonding;    thiazolidine ring;    Hirshfeld surface analysis;   

DOI  :  10.1107/S2056989019013069

来源: DOAJ

【 摘 要 】

In the cation of the title salt, C9H12N3S+·Br−, the thiazolidine ring adopts an envelope conformation with the C atom adjacent to the phenyl ring as the flap. In the crystal, N—H...Br hydrogen bonds link the components into a three-dimensional network. Weak π–π stacking interactions between the phenyl rings of adjacent cations also contribute to the molecular packing. A Hirshfeld surface analysis was conducted to quantify the contributions of the different intermolecular interactions and contacts.

【 授权许可】

Unknown