{"title":"1,1',1 \" -[(2-溴-氧基)甲烷-三基]三苯和1,1',1 \" -[(2-碘-氧基)甲烷-三基]三苯的合成与结构","authors":"Julian Fischer , Marian Hebenbrock","doi":"10.1107/S2056989025001124","DOIUrl":null,"url":null,"abstract":"<div><div>Both compounds crystallized from a saturated solution in THF by slow vapour diffusion of <em>n</em>-hexane in the monoclinic space group <em>P</em>2<sub>1</sub>/<em>c</em>. While the two independent molecules in the asymmetric unit of 1,1′,1′′-[(2-iodoethoxy)methanetriyl]tribenzene show no close contacts to other molecules, in the structure of 1,1′,1′′-[(2-bromoethoxy)methanetriyl]tribenzene the molecules interact with each other by C—H⋯π contacts.</div></div><div><div>The present study reports on the molecular structures and syntheses of 1,1′,1′′-[(2-bromoethoxy)methanetriyl]tribenzene, C<sub>21</sub>H<sub>19</sub>BrO, and 1,1′,1′′-[(2-iodoethoxy)methanetriyl]tribenzene, C<sub>21</sub>H<sub>19</sub>IO. Both compounds crystallized from a saturated solution in THF by slow vapour diffusion of <em>n</em>-hexane in the monoclinic space group <em>P</em>2<sub>1</sub>/<em>c</em>. While the two independent molecules in the asymmetric unit of 1,1′,1′′-[(2-iodoethoxy)methanetriyl]tribenzene show no close contacts to other molecules, in the structure of 1,1′,1′′-[(2-bromoethoxy)methanetriyl]tribenzene the molecules interact with each other <em>via</em> C—H⋯π contacts.</div></div>","PeriodicalId":7367,"journal":{"name":"Acta Crystallographica Section E: Crystallographic Communications","volume":"81 3","pages":"Pages 214-218"},"PeriodicalIF":0.5000,"publicationDate":"2025-03-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://www.ncbi.nlm.nih.gov/pmc/articles/PMC11891592/pdf/","citationCount":"0","resultStr":"{\"title\":\"Synthesis and structure of 1,1′,1′′-[(2-bromoethoxy)methanetriyl]tribenzene and 1,1′,1′′-[(2-iodoethoxy)methanetriyl]tribenzene\",\"authors\":\"Julian Fischer , Marian Hebenbrock\",\"doi\":\"10.1107/S2056989025001124\",\"DOIUrl\":null,\"url\":null,\"abstract\":\"<div><div>Both compounds crystallized from a saturated solution in THF by slow vapour diffusion of <em>n</em>-hexane in the monoclinic space group <em>P</em>2<sub>1</sub>/<em>c</em>. While the two independent molecules in the asymmetric unit of 1,1′,1′′-[(2-iodoethoxy)methanetriyl]tribenzene show no close contacts to other molecules, in the structure of 1,1′,1′′-[(2-bromoethoxy)methanetriyl]tribenzene the molecules interact with each other by C—H⋯π contacts.</div></div><div><div>The present study reports on the molecular structures and syntheses of 1,1′,1′′-[(2-bromoethoxy)methanetriyl]tribenzene, C<sub>21</sub>H<sub>19</sub>BrO, and 1,1′,1′′-[(2-iodoethoxy)methanetriyl]tribenzene, C<sub>21</sub>H<sub>19</sub>IO. Both compounds crystallized from a saturated solution in THF by slow vapour diffusion of <em>n</em>-hexane in the monoclinic space group <em>P</em>2<sub>1</sub>/<em>c</em>. While the two independent molecules in the asymmetric unit of 1,1′,1′′-[(2-iodoethoxy)methanetriyl]tribenzene show no close contacts to other molecules, in the structure of 1,1′,1′′-[(2-bromoethoxy)methanetriyl]tribenzene the molecules interact with each other <em>via</em> C—H⋯π contacts.</div></div>\",\"PeriodicalId\":7367,\"journal\":{\"name\":\"Acta Crystallographica Section E: Crystallographic Communications\",\"volume\":\"81 3\",\"pages\":\"Pages 214-218\"},\"PeriodicalIF\":0.5000,\"publicationDate\":\"2025-03-01\",\"publicationTypes\":\"Journal Article\",\"fieldsOfStudy\":null,\"isOpenAccess\":false,\"openAccessPdf\":\"https://www.ncbi.nlm.nih.gov/pmc/articles/PMC11891592/pdf/\",\"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/S2056989025000441\",\"RegionNum\":0,\"RegionCategory\":null,\"ArticlePicture\":[],\"TitleCN\":null,\"AbstractTextCN\":null,\"PMCID\":null,\"EPubDate\":\"\",\"PubModel\":\"\",\"JCR\":\"Q4\",\"JCRName\":\"CRYSTALLOGRAPHY\",\"Score\":null,\"Total\":0}","platform":"Semanticscholar","paperid":null,"PeriodicalName":"Acta Crystallographica Section E: Crystallographic Communications","FirstCategoryId":"1085","ListUrlMain":"https://www.sciencedirect.com/org/science/article/pii/S2056989025000441","RegionNum":0,"RegionCategory":null,"ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"Q4","JCRName":"CRYSTALLOGRAPHY","Score":null,"Total":0}
Synthesis and structure of 1,1′,1′′-[(2-bromoethoxy)methanetriyl]tribenzene and 1,1′,1′′-[(2-iodoethoxy)methanetriyl]tribenzene
Both compounds crystallized from a saturated solution in THF by slow vapour diffusion of n-hexane in the monoclinic space group P21/c. While the two independent molecules in the asymmetric unit of 1,1′,1′′-[(2-iodoethoxy)methanetriyl]tribenzene show no close contacts to other molecules, in the structure of 1,1′,1′′-[(2-bromoethoxy)methanetriyl]tribenzene the molecules interact with each other by C—H⋯π contacts.
The present study reports on the molecular structures and syntheses of 1,1′,1′′-[(2-bromoethoxy)methanetriyl]tribenzene, C21H19BrO, and 1,1′,1′′-[(2-iodoethoxy)methanetriyl]tribenzene, C21H19IO. Both compounds crystallized from a saturated solution in THF by slow vapour diffusion of n-hexane in the monoclinic space group P21/c. While the two independent molecules in the asymmetric unit of 1,1′,1′′-[(2-iodoethoxy)methanetriyl]tribenzene show no close contacts to other molecules, in the structure of 1,1′,1′′-[(2-bromoethoxy)methanetriyl]tribenzene the molecules interact with each other via C—H⋯π contacts.
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.