Kennedy, Alan and Khalaf, Abedawn I. and Suckling, Colin J. (2010) 2,2,2-Trifluoro-N-(isoquinolin-5-ylmethyl)acetamide. Acta Crystallographica Section E: Structure Reports, 66 (Pt 1). o135. ISSN 1600-5368
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Official URL: http://dx.doi.org/10.1107/S1600536809052994
Abstract
The molecular structure of the title compound at 123 K, C12H9F3N2O, presents a rotationally disordered CF3 group. Hydrogen bonds between the amide NH group and the N atom of the isoquinoline form a chain in the b-axis direction. The packed structure forms alternate layers of isoquinoline and amide groups parallel to the ab plane.
| Item type: | Article |
|---|---|
| ID code: | 27550 |
| Notes: | M1 - Copyright (C) 2011 U.S. National Library of Medicine. MEDLINE AN 2011519400(Journal; Article; (JOURNAL ARTICLE)) |
| Keywords: | single-crystal X-ray study, T = 123 K, disorder in main residue, R factor = 0.051, wR factor = 0.133, data-to-parameter = 10.8, Chemistry |
| Subjects: | Science > Chemistry |
| Department: | Faculty of Science > Pure and Applied Chemistry |
| Related URLs: | |
| Depositing user: | Ms Carol Khalaf |
| Date Deposited: | 01 Oct 2010 15:44 |
| Last modified: | 26 Apr 2012 06:52 |
| URI: | http://strathprints.strath.ac.uk/id/eprint/27550 |
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