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Information card for entry 2242047
Preview
| Coordinates | 2242047.cif |
|---|---|
| Structure factors | 2242047.hkl |
| Original IUCr paper | HTML |
| External links | PubChem |
| Chemical name | 1,1,2,2-Tetrabromoisopropyl-1,2-diphenyldisilane |
|---|---|
| Formula | C24 H34 Br4 Si2 |
| Calculated formula | C24 H34 Br4 Si2 |
| Title of publication | Crystal structures of three sterically congested disilanes |
| Authors of publication | Pichaandi, Kothanda Rama; Mague, Joel T.; Fink, Mark J. |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2017 |
| Journal volume | 73 |
| Journal issue | 3 |
| Pages of publication | 448 - 452 |
| a | 8.8779 ± 0.0007 Å |
| b | 10.4042 ± 0.0008 Å |
| c | 29.699 ± 0.002 Å |
| α | 90° |
| β | 90.975 ± 0.001° |
| γ | 90° |
| Cell volume | 2742.8 ± 0.4 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/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.0434 |
| Residual factor for significantly intense reflections | 0.0283 |
| Weighted residual factors for significantly intense reflections | 0.0574 |
| Weighted residual factors for all reflections included in the refinement | 0.0623 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.034 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301807 (current) | 2025-08-19 | Add cross-references to PubChem compounds in COD range 2/24 Each referenced PubChem compound corresponds to the full crystal structure. |
2242047.cif 2242047.hkl |
| 192759 | 2017-03-02 | cif/ hkl/ Adding structures of 2242046, 2242047, 2242048 via cif-deposit CGI script. |
2242047.cif 2242047.hkl |
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Users of the data should acknowledge the original authors of the
structural data.