Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7243194
Preview
Coordinates | 7243194.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C31 H26 N4 O3 S |
---|---|
Calculated formula | C31 H26 N4 O3 S |
Title of publication | Cocrystallization of axitinib with carboxylic acids: preparation, crystal structures and dissolution behavior |
Authors of publication | Ren, Bo-Ying; Dai, Xia-Lin; Wang, Jie; Wu, Chao; Lu, Tong-Bu; Chen, Jia-Mei |
Journal of publication | CrystEngComm |
Year of publication | 2021 |
Journal volume | 23 |
Journal issue | 32 |
Pages of publication | 5504 - 5515 |
a | 7.8512 ± 0.0001 Å |
b | 13.6163 ± 0.0002 Å |
c | 14.6035 ± 0.0002 Å |
α | 62.989 ± 0.001° |
β | 82.242 ± 0.001° |
γ | 79.912 ± 0.001° |
Cell volume | 1366.64 ± 0.03 Å3 |
Cell temperature | 275 ± 4 K |
Ambient diffraction temperature | 275 ± 4 K |
Number of distinct elements | 5 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0606 |
Residual factor for significantly intense reflections | 0.0573 |
Weighted residual factors for significantly intense reflections | 0.1629 |
Weighted residual factors for all reflections included in the refinement | 0.1673 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.084 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 1.54184 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7243194.html
All data in the COD and the database itself are dedicated to the
public domain and licensed under the
CC0
License
.
Users of the data should acknowledge the original authors of the
structural data.