Crystal Structure Analysis of 1, 4, 7-Trithia-10, 13-diazacyclopentadecane-9, 14-dione

Authors

Timothy M.E. Jugovic, Illinois State University
Christopher G. Hamaker, Illinois State UniversityFollow

Document Type

Article

Publication Date

2025

Publication Title

Journal of Chemical Crystallography

Keywords

crown ether, hydrogen bonding, crystal structure, Hirshfeld analysis

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.

Funding Source

This article was published Open Access thanks to a transformative agreement between Milner Library and Springer Nature.

Creative Commons License

This work is licensed under a Creative Commons Attribution-NonCommercial-No Derivative Works 4.0 International License.

DOI

10.1007/s10870-025-01054-5

Comments

First published in Journal of Chemical Crystallography (2025): https://doi.org/10.1007/s10870-025-01054-5

Supplemental data attached.

Recommended Citation

Jugovic, T.M., Hamaker, C.G. Crystal Structure Analysis of 1, 4, 7-Trithia-10, 13-diazacyclopentadecane-9, 14-dione. J Chem Crystallogr (2025). https://doi.org/10.1007/s10870-025-01054-5