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Information card for entry 7243721
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| Coordinates | 7243721.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | Clopamide hemihydrate |
|---|---|
| Chemical name | 4-chloro-N-(2,6-dimethylpiperidin-1-yl)-3-sulfamoylbenzamide hemihydrate |
| Formula | C28 H40 Cl2 N6 O7 S2 |
| Calculated formula | C28 H40 Cl2 N6 O7 S2 |
| Title of publication | Solvatomorph and polymorph screening of clopamide drug and its copper(ii) complex crystals |
| Authors of publication | Gál, G. Tamás; May, Nóra V.; Trif, László; Mihály, Judith; Bombicz, Petra |
| Journal of publication | CrystEngComm |
| Year of publication | 2021 |
| Journal volume | 23 |
| Journal issue | 42 |
| Pages of publication | 7425 - 7441 |
| a | 14.5166 ± 0.0008 Å |
| b | 9.3747 ± 0.0007 Å |
| c | 24.7064 ± 0.0017 Å |
| α | 90° |
| β | 100.965 ± 0.002° |
| γ | 90° |
| Cell volume | 3300.9 ± 0.4 Å3 |
| Cell temperature | 103 ± 2 K |
| Ambient diffraction temperature | 103 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for all reflections | 0.0508 |
| Residual factor for significantly intense reflections | 0.0438 |
| Weighted residual factors for significantly intense reflections | 0.1063 |
| Weighted residual factors for all reflections included in the refinement | 0.1109 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.049 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 270419 (current) | 2021-11-06 | cif/ Updating files of 7243712, 7243713, 7243714, 7243715, 7243716, 7243717, 7243718, 7243719, 7243720, 7243721 Original log message: Adding full bibliography for 7243712--7243721.cif. |
7243721.cif |
| 269884 | 2021-10-11 | cif/ Adding structures of 7243712, 7243713, 7243714, 7243715, 7243716, 7243717, 7243718, 7243719, 7243720, 7243721 via cif-deposit CGI script. |
7243721.cif |
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Users of the data should acknowledge the original authors of the
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