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Information card for entry 7717900
Preview
| Coordinates | 7717900.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C21 H38 B N3 |
|---|---|
| Calculated formula | C21 H38 B N3 |
| Title of publication | Synthesis of base-free boriranes and their conversion to borirenes using strong reductant. |
| Authors of publication | Dotzauer, Simon; Kar, Sourav; Swoboda, Theresa; Weidemann, Christoph; Häfner, Andreas; Dewhurst, Rian D.; Braunschweig, Holger |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2025 |
| Journal volume | 54 |
| Journal issue | 9 |
| Pages of publication | 3857 - 3862 |
| a | 12.2086 ± 0.0003 Å |
| b | 11.1581 ± 0.0002 Å |
| c | 16.0725 ± 0.0003 Å |
| α | 90° |
| β | 105.649 ± 0.002° |
| γ | 90° |
| Cell volume | 2108.31 ± 0.08 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.0494 |
| Residual factor for significantly intense reflections | 0.0412 |
| Weighted residual factors for significantly intense reflections | 0.1057 |
| Weighted residual factors for all reflections included in the refinement | 0.1107 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.058 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Diffraction radiation X-ray symbol | K-L~2,3~ |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 298915 (current) | 2025-04-05 | cif/ Updating files of 7717899, 7717900, 7717901, 7717902, 7717903, 7717904, 7717905 Original log message: Adding full bibliography for 7717899--7717905.cif. |
7717900.cif |
| 297493 | 2025-01-28 | cif/ Adding structures of 7717899, 7717900, 7717901, 7717902, 7717903, 7717904, 7717905 via cif-deposit CGI script. |
7717900.cif |
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Users of the data should acknowledge the original authors of the
structural data.