Information card for entry 7238040
| Formula |
C14 H11 F3 N2 O2 |
| Calculated formula |
C14 H11 F3 N2 O2 |
| Title of publication |
An investigation of the polymorphism of a potent nonsteroidal anti-inflammatory drug flunixin |
| Authors of publication |
Liu, Hao; Yang, Xing; Wu, Shanyu; Zhang, Mingtao; Parkin, Sean; Cao, Shuang; Li, Tonglei; Yu, Faquan; Long, Sihui |
| Journal of publication |
CrystEngComm |
| Year of publication |
2020 |
| Journal volume |
22 |
| Journal issue |
3 |
| Pages of publication |
448 - 457 |
| a |
7.538 ± 0.0001 Å |
| b |
14.0607 ± 0.0002 Å |
| c |
12.3766 ± 0.0001 Å |
| α |
90° |
| β |
103.32 ± 0.0005° |
| γ |
90° |
| Cell volume |
1276.5 ± 0.03 Å3 |
| Cell temperature |
90 ± 2 K |
| Ambient diffraction temperature |
90 ± 2 K |
| Number of distinct elements |
5 |
| Space group number |
14 |
| Hermann-Mauguin space group symbol |
P 1 21/c 1 |
| Hall space group symbol |
-P 2ybc |
| Residual factor for all reflections |
0.0453 |
| Residual factor for significantly intense reflections |
0.0391 |
| Weighted residual factors for significantly intense reflections |
0.0929 |
| Weighted residual factors for all reflections included in the refinement |
0.0971 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.057 |
| 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/7238040.html
