{"title":"Crystal structure and supramolecular features of bis{ethyl 2-[1-methyl-3-(pyridin-2-yl)-1H-1,2,4-triazol-5-yl]acetate}trinitratolanthanum(III)","authors":"Valeriia Halushchenko , Oleksandr Korovin , Natalya Rusakova , Viktoriya Dyakonenko , Dmytro Khomenko , Rostyslav Lampeka , Serhii Smola","doi":"10.1107/S2056989025005419","DOIUrl":null,"url":null,"abstract":"<div><div>The crystal structure of a mononuclear 12-coordinate lanthanum(III) complex with a pyridinyl-1,2,4-triazole derivative is reported and discussed.</div></div><div><div>The title lanthanum(III) complex, [La(Et-MPTA)<sub>2</sub>(NO<sub>3</sub>)<sub>3</sub>] {where Et-MPTA is ethyl 2-[1-methyl-3-(pyridin-2-yl)-1<em>H</em>-1,2,4-triazol-5-yl]acetate} or [La(C<sub>24</sub>H<sub>28</sub>N<sub>8</sub>O<sub>4</sub>)(NO<sub>3</sub>)<sub>3</sub>], crystallizes in the monoclinic space group <em>C</em>2/<em>c</em> (No. 15). The lanthanum atom is twelve-coordinate, bonded to two oxygen atoms from carboxylate groups, four nitrogen atoms from two pyridinyl-1,2,4-triazole ligands, and six oxygen atoms of three NO<sub>3</sub><sup>−</sup> anions. The coordination geometry around the lanthanum atom can be described as a distorted icosahedron. Supramolecular features include π-stacking interactions between pyridyl and triazole rings and weak intermolecular N—O⋯C interactions, which lead to the formation of layers parallel to the (101) plane.</div></div>","PeriodicalId":7367,"journal":{"name":"Acta Crystallographica Section E: Crystallographic Communications","volume":"81 7","pages":"Pages 632-635"},"PeriodicalIF":0.6000,"publicationDate":"2025-07-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"0","resultStr":null,"platform":"Semanticscholar","paperid":null,"PeriodicalName":"Acta Crystallographica Section E: Crystallographic Communications","FirstCategoryId":"1085","ListUrlMain":"https://www.sciencedirect.com/org/science/article/pii/S2056989025001124","RegionNum":0,"RegionCategory":null,"ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"Q4","JCRName":"CRYSTALLOGRAPHY","Score":null,"Total":0}
引用次数: 0
Abstract
The crystal structure of a mononuclear 12-coordinate lanthanum(III) complex with a pyridinyl-1,2,4-triazole derivative is reported and discussed.
The title lanthanum(III) complex, [La(Et-MPTA)2(NO3)3] {where Et-MPTA is ethyl 2-[1-methyl-3-(pyridin-2-yl)-1H-1,2,4-triazol-5-yl]acetate} or [La(C24H28N8O4)(NO3)3], crystallizes in the monoclinic space group C2/c (No. 15). The lanthanum atom is twelve-coordinate, bonded to two oxygen atoms from carboxylate groups, four nitrogen atoms from two pyridinyl-1,2,4-triazole ligands, and six oxygen atoms of three NO3− anions. The coordination geometry around the lanthanum atom can be described as a distorted icosahedron. Supramolecular features include π-stacking interactions between pyridyl and triazole rings and weak intermolecular N—O⋯C interactions, which lead to the formation of layers parallel to the (101) plane.
期刊介绍:
Acta Crystallographica Section E: Crystallographic Communications is the IUCr''s open-access structural communications journal. It provides a fast, simple and easily accessible publication mechanism for crystal structure determinations of inorganic, metal-organic and organic compounds. The electronic submission, validation, refereeing and publication facilities of the journal ensure rapid and high-quality publication of fully validated structures. The primary article category is Research Communications; these are peer-reviewed articles describing one or more structure determinations with appropriate discussion of the science.