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Information card for entry 1564496
Preview
| Coordinates | 1564496.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C25 H35 N O5 |
|---|---|
| Calculated formula | C25 H35 N O5 |
| Title of publication | Palladium Catalyzed C-H Glycosylation and Retro Diels-Alder Tandem Reaction via Structurally Modified Norbornadiene (smNBDs) |
| Authors of publication | An, Yang; Zhang, Bo-Sheng; Ding, Ya-Nan; Zhang, Zhe; Gou, Xue-Ya; Li, Xue-Song; Wang, Xiaolei; Li, Yuke; Liang, Yong-Min |
| Journal of publication | Chemical Science |
| Year of publication | 2021 |
| a | 11.0067 ± 0.0003 Å |
| b | 9.2663 ± 0.0002 Å |
| c | 24.1638 ± 0.0008 Å |
| α | 90° |
| β | 99.36 ± 0.003° |
| γ | 90° |
| Cell volume | 2431.69 ± 0.12 Å3 |
| Cell temperature | 293.77 ± 0.1 K |
| Ambient diffraction temperature | 293.77 ± 0.1 K |
| Number of distinct elements | 4 |
| Space group number | 5 |
| Hermann-Mauguin space group symbol | I 1 2 1 |
| Hall space group symbol | I 2y |
| Residual factor for all reflections | 0.0478 |
| Residual factor for significantly intense reflections | 0.0426 |
| Weighted residual factors for significantly intense reflections | 0.1053 |
| Weighted residual factors for all reflections included in the refinement | 0.1115 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.056 |
| 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 |
|---|---|---|---|
| 268333 (current) | 2021-09-01 | cif/ Adding structures of 1564494, 1564495, 1564496 via cif-deposit CGI script. |
1564496.cif |
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Users of the data should acknowledge the original authors of the
structural data.