{"title":"溴化蒎烯","authors":"Yoann Rousselin , Alexandre Clavel","doi":"10.1107/S2414314624006539","DOIUrl":null,"url":null,"abstract":"<div><p>The title compound is a morpholinium derivative with the positive charge located on the N atom.</p></div><div><p>The structure of pinaverium bromide (systematic name: 4-[(2-bromo-4,5-dimethoxyphenyl)methyl]-4-{2-[2-(6,6-dimethyl-2-bicyclo[3.1.1]heptanyl)ethoxy]ethyl}morpholin-4-ium bromide; C<sub>26</sub>H<sub>41</sub>Br<sub>2</sub>NO<sub>4</sub>), was determined at 110 K. It has monoclinic (<em>P</em>2<sub>1</sub>) symmetry. It is of interest with respect to its anti-inflammatory properties. The asymmetric unit contains two independent molecules, one of which exhibits disorder of the bicyclo terminal group (occupancy factors: 0.78 and 0.22).<span><figure><span><img><ol><li><span><span>Download: <span>Download high-res image (203KB)</span></span></span></li><li><span><span>Download: <span>Download full-size image</span></span></span></li></ol></span></figure></span></p></div>","PeriodicalId":94324,"journal":{"name":"IUCrData","volume":"9 8","pages":""},"PeriodicalIF":0.0000,"publicationDate":"2024-08-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"0","resultStr":"{\"title\":\"Pinaverium bromide\",\"authors\":\"Yoann Rousselin , Alexandre Clavel\",\"doi\":\"10.1107/S2414314624006539\",\"DOIUrl\":null,\"url\":null,\"abstract\":\"<div><p>The title compound is a morpholinium derivative with the positive charge located on the N atom.</p></div><div><p>The structure of pinaverium bromide (systematic name: 4-[(2-bromo-4,5-dimethoxyphenyl)methyl]-4-{2-[2-(6,6-dimethyl-2-bicyclo[3.1.1]heptanyl)ethoxy]ethyl}morpholin-4-ium bromide; C<sub>26</sub>H<sub>41</sub>Br<sub>2</sub>NO<sub>4</sub>), was determined at 110 K. It has monoclinic (<em>P</em>2<sub>1</sub>) symmetry. It is of interest with respect to its anti-inflammatory properties. The asymmetric unit contains two independent molecules, one of which exhibits disorder of the bicyclo terminal group (occupancy factors: 0.78 and 0.22).<span><figure><span><img><ol><li><span><span>Download: <span>Download high-res image (203KB)</span></span></span></li><li><span><span>Download: <span>Download full-size image</span></span></span></li></ol></span></figure></span></p></div>\",\"PeriodicalId\":94324,\"journal\":{\"name\":\"IUCrData\",\"volume\":\"9 8\",\"pages\":\"\"},\"PeriodicalIF\":0.0000,\"publicationDate\":\"2024-08-01\",\"publicationTypes\":\"Journal Article\",\"fieldsOfStudy\":null,\"isOpenAccess\":false,\"openAccessPdf\":\"\",\"citationCount\":\"0\",\"resultStr\":null,\"platform\":\"Semanticscholar\",\"paperid\":null,\"PeriodicalName\":\"IUCrData\",\"FirstCategoryId\":\"1085\",\"ListUrlMain\":\"https://www.sciencedirect.com/org/science/article/pii/S2414314624000798\",\"RegionNum\":0,\"RegionCategory\":null,\"ArticlePicture\":[],\"TitleCN\":null,\"AbstractTextCN\":null,\"PMCID\":null,\"EPubDate\":\"\",\"PubModel\":\"\",\"JCR\":\"\",\"JCRName\":\"\",\"Score\":null,\"Total\":0}","platform":"Semanticscholar","paperid":null,"PeriodicalName":"IUCrData","FirstCategoryId":"1085","ListUrlMain":"https://www.sciencedirect.com/org/science/article/pii/S2414314624000798","RegionNum":0,"RegionCategory":null,"ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"","JCRName":"","Score":null,"Total":0}
引用次数: 0
摘要
在 110 K 温度下测定了溴化吡喹啉（系统名称：4-[(2-溴-4,5-二甲氧基苯基)甲基]-4-{2-[2-(6,6-二甲基-2-双环[3.1.1]庚基)乙氧基]乙基}吗啉-4-鎓溴化物；C26H41Br2NO4）的结构。它具有单斜（P21）对称性。它的抗炎特性令人感兴趣。该不对称单元包含两个独立的分子，其中一个分子的双环末端基团呈现无序状态（占位系数：0.78 和 0.22）：下载高清图片 (203KB)Download：下载全尺寸图片
The title compound is a morpholinium derivative with the positive charge located on the N atom.
The structure of pinaverium bromide (systematic name: 4-[(2-bromo-4,5-dimethoxyphenyl)methyl]-4-{2-[2-(6,6-dimethyl-2-bicyclo[3.1.1]heptanyl)ethoxy]ethyl}morpholin-4-ium bromide; C26H41Br2NO4), was determined at 110 K. It has monoclinic (P21) symmetry. It is of interest with respect to its anti-inflammatory properties. The asymmetric unit contains two independent molecules, one of which exhibits disorder of the bicyclo terminal group (occupancy factors: 0.78 and 0.22).
京公网安备 11010802042870号
京ICP备2023020795号-1
分享
求助内容：
应助结果提醒方式：
扫码关注我们
