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Information card for entry 1575091
Preview
| Coordinates | 1575091.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C29 H32 B Br O4 |
|---|---|
| Calculated formula | C29 H32 B Br O4 |
| Title of publication | Cu(I)-Catalyzed Enantioselective and Stereospecific Borylative Annulation of Cyclic 1,3-Dione-Tethered 1,3-Enynes |
| Authors of publication | Raghu Ramudu, G.; Patil, Vaibhav B.; Nanubolu, Jagadeesh Babu; Chegondi, Rambabu |
| Journal of publication | Chemical Science |
| Year of publication | 2025 |
| a | 6.661 ± 0.002 Å |
| b | 19.722 ± 0.005 Å |
| c | 20.481 ± 0.005 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 2690.6 ± 1.2 Å3 |
| Cell temperature | 294 ± 2 K |
| Ambient diffraction temperature | 294 ± 2 K |
| Number of distinct elements | 5 |
| 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 | 0.1134 |
| Residual factor for significantly intense reflections | 0.0462 |
| Weighted residual factors for significantly intense reflections | 0.1034 |
| Weighted residual factors for all reflections included in the refinement | 0.1278 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.01 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301253 (current) | 2025-07-15 | cif/ Adding structures of 1575090, 1575091 via cif-deposit CGI script. |
1575091.cif |
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Users of the data should acknowledge the original authors of the
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