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Information card for entry 7249683
Preview
| Coordinates | 7249683.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Chemical name | D-leucinium D-di-p-toluoyltartrate semihydrate |
|---|---|
| Formula | C52 H64 N2 O21 |
| Calculated formula | C52 H64 N2 O21 |
| Title of publication | Chiral resolution of dl-leucine via salifying tartaric acid derivatives |
| Authors of publication | Shi, Linlin; Guo, Zhiqiang; Luo, Xiaofang; Hou, Lingli; Wu, Hongchang; De, Ruiyu; Huang, Xin; Wang, Ting; Hao, Hongxun; Wang, Na; Zhou, Lina |
| Journal of publication | CrystEngComm |
| Year of publication | 2025 |
| a | 27.9114 ± 0.0002 Å |
| b | 12.8536 ± 0.0001 Å |
| c | 15.9008 ± 0.0001 Å |
| α | 90° |
| β | 106.049 ± 0.001° |
| γ | 90° |
| Cell volume | 5482.27 ± 0.07 Å3 |
| Cell temperature | 128.15 K |
| Ambient diffraction temperature | 128.15 K |
| Number of distinct elements | 4 |
| Space group number | 5 |
| Hermann-Mauguin space group symbol | C 1 2 1 |
| Hall space group symbol | C 2y |
| Residual factor for all reflections | 0.0387 |
| Residual factor for significantly intense reflections | 0.0385 |
| Weighted residual factors for significantly intense reflections | 0.1079 |
| Weighted residual factors for all reflections included in the refinement | 0.1081 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.05 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 296832 (current) | 2024-12-11 | cif/ Adding structures of 7249682, 7249683 via cif-deposit CGI script. |
7249683.cif |
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