| Literature DB >> 34925907 |
Mariia O Shyshkina1, Svitlana V Shishkina1, Konstantin S Ostras1, Nikolay Yu Gorobets1, Valentyn A Chebanov1, Sergey M Desenko1.
Abstract
The title complex, systematic name catena-poly[[[acetato-chlorido-zinc(II)]-μ-(5R,6R,7S)-5-(furan-2-yl)-7-phenyl-4,5,6,7-tetra-hydro-[1,2,4]triazolo[1,5-a]py-rimi-din-6-amine] monohydrate], {[Zn(C2H3O2)Cl(C15H15N5O)]·H2O} n , is the first coordination complex in which the neutral tetra-hydro-triazolo-pyrimidine derivative acts as bridging ligand between two zinc mol-ecules. As a result, polymeric chains of the coordination complex are found. The coordination of the zinc metal atom occurs with the lone pairs of the triazolo nitro-gen atom and amino group. The positive charge of the zinc atom is compensated by the chlorine anion and deprotonated acetic acid. The coordination complex exists as a monohydrate in the crystalline phase. The water mol-ecules bind neighbouring polymeric chains by the formation of O-H⋯O, O-H⋯Cl and N-H⋯O hydrogen bonds. © Shyshkina et al. 2021.Entities:
Keywords: (5R,6R,7S)-5-(furan-2-yl)-7-phenyl-4,5,6,7-tetrahydro-[1,2,4]triazolo[1,5-α]pyrimidin-6-aminozinc(II)acetate-chloride; Hirshfeld surface analysis; crystal structure; molecular structure; polymeric coordination complex
Year: 2021 PMID: 34925907 PMCID: PMC8647737 DOI: 10.1107/S2056989021012226
Source DB: PubMed Journal: Acta Crystallogr E Crystallogr Commun