Crystal structure and Hirshfeld surface analysis of 2-amino-5-{(1<i>E</i>)-1-[(carbamothioylamino)imino]ethyl}-4-methyl-1,3-thiazol-3-ium chloride monohydrate
نویسندگان
چکیده
In the hydrated title salt, C 7 H 12 N 5 S 2 + ·Cl − ·H O, asymmetric unit comprises one 2-amino-5-{(1 E )-1-[(carbamothioylamino)imino]ethyl}-4-methyl-1,3-thiazol-3-ium cation, chloride anion and water molecule of crystallization. The cation is nearly flat (r.m.s. deviation non-H atoms 0.0814 Å), with largest 0.1484 (14) Å observed for methyl atoms. crystal, cations are linked by O—H...Cl, N—H...Cl, N—H...O, N—H...S C—H...S hydrogen bonds, forming a tri-periodic network. most important contributions to crystal packing from H...H (35.4%), S...H/H...S (24.4%), N...H/H...N (8.7%), Cl...H/H...Cl (8.2%) C...H/H...C (7.7%) interactions.
منابع مشابه
2-Amino-5-ethoxycarbonyl-4-methylthiazol-3-ium chloride monohydrate
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ژورنال
عنوان ژورنال: Acta Crystallographica Section E: Crystallographic Communications
سال: 2023
ISSN: ['2056-9890']
DOI: https://doi.org/10.1107/s2056989023007090