{"title":"Crystal Structure Analysis of 1, 4, 7-Trithia-10, 13-diazacyclopentadecane-9, 14-dione","authors":"Timothy M.E. Jugovic, Christopher G. Hamaker","doi":"10.1007/s10870-025-01054-5","DOIUrl":null,"url":null,"abstract":"<div>\n \n <p>The compound 1,4,7-trithia-10,13-diazacyclopentadecane-9,14-dione, <b>1</b>, crystallizes in the space group <i>P</i>2<sub>1</sub>/<i>c</i> with <i>a</i> = 9.3608(3) Å, <i>b</i> = 16.0333(5) Å, <i>c</i> = 9.5608(3) Å, <i>β</i> = 113.3521(14)°, and <i>Z</i> = 4. The title molecule forms chains via face-to-face N–H<sup>…</sup>O hydrogen bonds. The structure of <b>1</b> is also compared to the previously reported oxygen analog, 1,4,7-trioxa-10,13-diazacyclopentadecane-9,14-dione.</p>\n </div>","PeriodicalId":615,"journal":{"name":"Journal of Chemical Crystallography","volume":"55 4","pages":"244 - 250"},"PeriodicalIF":0.6000,"publicationDate":"2025-06-12","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://link.springer.com/content/pdf/10.1007/s10870-025-01054-5.pdf","citationCount":"0","resultStr":null,"platform":"Semanticscholar","paperid":null,"PeriodicalName":"Journal of Chemical Crystallography","FirstCategoryId":"92","ListUrlMain":"https://link.springer.com/article/10.1007/s10870-025-01054-5","RegionNum":4,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"Q4","JCRName":"CRYSTALLOGRAPHY","Score":null,"Total":0}
引用次数: 0
Abstract
The compound 1,4,7-trithia-10,13-diazacyclopentadecane-9,14-dione, 1, crystallizes in the space group P21/c with a = 9.3608(3) Å, b = 16.0333(5) Å, c = 9.5608(3) Å, β = 113.3521(14)°, and Z = 4. The title molecule forms chains via face-to-face N–H…O hydrogen bonds. The structure of 1 is also compared to the previously reported oxygen analog, 1,4,7-trioxa-10,13-diazacyclopentadecane-9,14-dione.
期刊介绍:
Journal of Chemical Crystallography is an international and interdisciplinary publication dedicated to the rapid dissemination of research results in the general areas of crystallography and spectroscopy. Timely research reports detail topics in crystal chemistry and physics and their relation to problems of molecular structure; structural studies of solids, liquids, gases, and solutions involving spectroscopic, spectrometric, X-ray, and electron and neutron diffraction; and theoretical studies.