Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7232919
Preview
| Coordinates | 7232919.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C30 H27 Cl N6 O6 S |
|---|---|
| Calculated formula | C30 H27 Cl N6 O6 S |
| Title of publication | Piroxicam–clonixin drug–drug cocrystal solvates with enhanced hydration stability |
| Authors of publication | Li, Duanxiu; Li, Jiong; Deng, Zongwu; Zhang, Hailu |
| Journal of publication | CrystEngComm |
| Year of publication | 2019 |
| Journal volume | 21 |
| Journal issue | 28 |
| Pages of publication | 4145 |
| a | 7.2364 ± 0.0008 Å |
| b | 13.684 ± 0.002 Å |
| c | 15.767 ± 0.002 Å |
| α | 71.515 ± 0.013° |
| β | 83.596 ± 0.01° |
| γ | 81.899 ± 0.011° |
| Cell volume | 1462.2 ± 0.3 Å3 |
| Cell temperature | 193 ± 2 K |
| Ambient diffraction temperature | 193 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.1017 |
| Residual factor for significantly intense reflections | 0.055 |
| Weighted residual factors for significantly intense reflections | 0.1097 |
| Weighted residual factors for all reflections included in the refinement | 0.1293 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.025 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301866 (current) | 2025-08-23 | Add cross-references to PubChem compounds in COD range 7/23/ Each referenced PubChem compound corresponds to the full crystal structure. |
7232919.cif |
| 223473 | 2019-11-07 | cif/ Updating files of 7232919, 7232920, 7232921, 7232922, 7232923 Original log message: Adding full bibliography for 7232919--7232923.cif. |
7232919.cif |
| 216433 | 2019-06-21 | cif/ Adding structures of 7232919, 7232920, 7232921, 7232922, 7232923 via cif-deposit CGI script. |
7232919.cif |
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.