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Information card for entry 3000323
Preview
No preview available: structure is on hold until 2022-04-12
| Coordinates | Coordinates are not available: structure is on hold until 2022-04-12 |
|---|
| Chemical name | methyl-(2R*,3R*,4S*)-4-(4-methoxyphenyl)-2-(2-oxo-2-phenylethyl)-3-phenyl- 3,4-dihydro-2H-pyran-6-carboxylate |
|---|---|
| Formula | C28 H26 O5 |
| Authors of publication | Rakovský, Erik; Šebesta, Radovan |
| Journal of publication | To be published |
| a | 13.259 ± 0.0002 Å |
| b | 9.7084 ± 0.0001 Å |
| c | 17.5639 ± 0.0002 Å |
| α | 90° |
| β | 102.739 ± 0.001° |
| γ | 90° |
| Cell volume | 2205.24 ± 0.05 Å3 |
| Cell temperature | 100 K |
| Ambient diffraction temperature | 100 K |
| Number of distinct elements | 3 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.0114 |
| Residual factor for significantly intense reflections | 0.0114 |
| Weighted residual factors for significantly intense reflections | 0.0266 |
| Weighted residual factors for all reflections included in the refinement | 0.0266 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.0659 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54186 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | No |
| Has disorder | No |
| Has Fobs | No |
Version history
Not available for prepublication material.
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Users of the data should acknowledge the original authors of the
structural data.