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Information card for entry 1550758
Preview
| Coordinates | 1550758.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C35 H82 B4 N6 S4 Si4 |
|---|---|
| Calculated formula | C35 H82 B4 N6 S4 Si4 |
| Title of publication | Synthesis of Unsymmetrical B2E2 and B2E3 Heterocycles by Borylene Insertion into Boradichalcogeniranes |
| Authors of publication | Liu, Siyuan; Légaré, Marc-André; Hofmann, Alexander; Rempel, Anna; Hagspiel, Stephan; Braunschweig, Holger |
| Journal of publication | Chemical Science |
| Year of publication | 2019 |
| a | 9.1005 ± 0.001 Å |
| b | 11.8019 ± 0.0013 Å |
| c | 12.4035 ± 0.0013 Å |
| α | 80.466 ± 0.003° |
| β | 84.795 ± 0.003° |
| γ | 86.977 ± 0.004° |
| Cell volume | 1307.4 ± 0.2 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0701 |
| Residual factor for significantly intense reflections | 0.0621 |
| Weighted residual factors for significantly intense reflections | 0.1655 |
| Weighted residual factors for all reflections included in the refinement | 0.1725 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.016 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 214197 (current) | 2019-03-20 | cif/ Adding structures of 1550755, 1550756, 1550757, 1550758, 1550759, 1550760, 1550761 via cif-deposit CGI script. |
1550758.cif |
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Users of the data should acknowledge the original authors of the
structural data.