Information card for entry 7156701
| Formula |
C25 H22 Br F3 N2 O5 S |
| Calculated formula |
C25 H22 Br F3 N2 O5 S |
| Title of publication |
The asymmetric construction of CF<sub>3</sub>-containing spiro-thiazolone-pyrrolidine compounds via [3 + 2] cycloaddition. |
| Authors of publication |
Li, Boyu; Liu, Jikun; Gao, Fengyun; Sun, Mengmeng; Guo, Yifei; Zhou, Yuan; Wen, Dongwa; Deng, Yabo; Chen, Hui; Wang, Kairong; Yan, Wenjin |
| Journal of publication |
Organic & biomolecular chemistry |
| Year of publication |
2019 |
| Journal volume |
17 |
| Journal issue |
11 |
| Pages of publication |
2892 - 2895 |
| a |
12.4079 ± 0.0007 Å |
| b |
12.825 ± 0.0007 Å |
| c |
12.9266 ± 0.0008 Å |
| α |
97.287 ± 0.005° |
| β |
100.642 ± 0.005° |
| γ |
93.026 ± 0.005° |
| Cell volume |
1999.2 ± 0.2 Å3 |
| Cell temperature |
298.84 ± 0.1 K |
| Ambient diffraction temperature |
298.84 ± 0.1 K |
| Number of distinct elements |
7 |
| Space group number |
1 |
| Hermann-Mauguin space group symbol |
P 1 |
| Hall space group symbol |
P 1 |
| Residual factor for all reflections |
0.1146 |
| Residual factor for significantly intense reflections |
0.0553 |
| Weighted residual factors for significantly intense reflections |
0.0815 |
| Weighted residual factors for all reflections included in the refinement |
0.1032 |
| Goodness-of-fit parameter for all reflections included in the refinement |
0.999 |
| Diffraction radiation probe |
x-ray |
| Diffraction radiation wavelength |
0.71073 Å |
| Diffraction radiation type |
MoKα |
| Has coordinates |
Yes |
| Has disorder |
No |
| Has Fobs |
No |
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The link is:
https://www.crystallography.net/7156701.html
