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Information card for entry 2312353
Preview
| Coordinates | 2312353.cif |
|---|---|
| Structure factors | 2312353.hkl |
| Original paper (by DOI) | HTML |
| Formula | C26 H30 N2 O2 |
|---|---|
| Calculated formula | C26 H30 N2 O2 |
| Title of publication | A drug-drug cocrystal and a co-amorphous form, prepared from honokiol and ligustrazine, inspired by Chinese patent medicine. |
| Authors of publication | Zhang, Yanli; Liu, Hui; Chen, Zongxin; Meng, Jialei; Li, Yunfeng; Qi, Luyao; Zhang, Suiliang; Chen, Xiaofeng; Lei, Ming |
| Journal of publication | Acta crystallographica Section B, Structural science, crystal engineering and materials |
| Year of publication | 2023 |
| Journal volume | 79 |
| Journal issue | 6 |
| a | 8.0045 ± 0.0005 Å |
| b | 9.2035 ± 0.0006 Å |
| c | 15.821 ± 0.001 Å |
| α | 90.211 ± 0.002° |
| β | 102.112 ± 0.002° |
| γ | 93.805 ± 0.002° |
| Cell volume | 1136.88 ± 0.13 Å3 |
| Cell temperature | 170 K |
| Ambient diffraction temperature | 170 K |
| Number of distinct elements | 4 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.149 |
| Residual factor for significantly intense reflections | 0.0692 |
| Weighted residual factors for significantly intense reflections | 0.1332 |
| Weighted residual factors for all reflections included in the refinement | 0.1748 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.056 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 287638 (current) | 2023-11-16 | cif/ hkl/ Adding structures of 2312353 via cif-deposit CGI script. |
2312353.cif 2312353.hkl |
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