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Information card for entry 7233541
Preview
| Coordinates | 7233541.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | Synephrine-DL-Tartaric acid 2:1 salt |
|---|---|
| Formula | C22 H32 N2 O10 |
| Calculated formula | C22 H32 N2 O10 |
| Title of publication | Cation∙∙∙Cation Hydrogen Bonds in Synephrine Salts: A Typical Interaction in an Unusual Environment. |
| Authors of publication | Dash, Sibananda G.; Thakur, Tejender S. |
| Journal of publication | Physical Chemistry Chemical Physics |
| Year of publication | 2019 |
| a | 9.5357 ± 0.0003 Å |
| b | 11.1714 ± 0.0003 Å |
| c | 11.4964 ± 0.0003 Å |
| α | 89.067 ± 0.002° |
| β | 70.401 ± 0.003° |
| γ | 79.552 ± 0.002° |
| Cell volume | 1133.28 ± 0.06 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 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 | 0.0612 |
| Residual factor for significantly intense reflections | 0.0495 |
| Weighted residual factors for significantly intense reflections | 0.1182 |
| Weighted residual factors for all reflections included in the refinement | 0.1287 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.029 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 217820 (current) | 2019-08-29 | cif/ Adding structures of 7233533, 7233534, 7233535, 7233536, 7233537, 7233538, 7233539, 7233540, 7233541, 7233542, 7233543 via cif-deposit CGI script. |
7233541.cif |
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Users of the data should acknowledge the original authors of the
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