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Information card for entry 7160506
Preview
| Coordinates | 7160506.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C21 H29 N O6 |
|---|---|
| Calculated formula | C21 H29 N O6 |
| Title of publication | Synthesis of 2-Acetylnoviosamine by Hydrogenolytic Cleavage of a Spirocyclopropane |
| Authors of publication | Salim, Maruan David; Ferrara, Isabella; Blacque, Olivier; Gademann, Karl |
| Journal of publication | Organic & Biomolecular Chemistry |
| Year of publication | 2025 |
| a | 14.7354 ± 0.0002 Å |
| b | 15.1012 ± 0.0002 Å |
| c | 29.1138 ± 0.0003 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 6478.47 ± 0.14 Å3 |
| Cell temperature | 160 ± 0.1 K |
| Ambient diffraction temperature | 160 ± 0.1 K |
| Number of distinct elements | 4 |
| Space group number | 19 |
| Hermann-Mauguin space group symbol | P 21 21 21 |
| Hall space group symbol | P 2ac 2ab |
| Residual factor for all reflections | 0.0522 |
| Residual factor for significantly intense reflections | 0.048 |
| Weighted residual factors for significantly intense reflections | 0.1262 |
| Weighted residual factors for all reflections included in the refinement | 0.1319 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.04 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 299324 (current) | 2025-04-18 | cif/ Adding structures of 7160505, 7160506 via cif-deposit CGI script. |
7160506.cif |
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Users of the data should acknowledge the original authors of the
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