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Information card for entry 7703471
Preview
| Coordinates | 7703471.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C50 H78 B Si2 |
|---|---|
| Calculated formula | C50 H78 B Si2 |
| Title of publication | 2,5-Bis-trimethylsilyl substituted boroles. |
| Authors of publication | Heitkemper, Tobias; Naß, Leonard; Sindlinger, Christian P. |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2020 |
| Journal volume | 49 |
| Journal issue | 8 |
| Pages of publication | 2706 - 2714 |
| a | 13.7584 ± 0.0009 Å |
| b | 14.0442 ± 0.0009 Å |
| c | 14.1442 ± 0.0009 Å |
| α | 67.341 ± 0.001° |
| β | 73.098 ± 0.001° |
| γ | 87.994 ± 0.001° |
| Cell volume | 2403.9 ± 0.3 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0846 |
| Residual factor for significantly intense reflections | 0.0533 |
| Weighted residual factors for significantly intense reflections | 0.1254 |
| Weighted residual factors for all reflections included in the refinement | 0.1397 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.021 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301878 (current) | 2025-08-23 | Add cross-references to PubChem compounds in COD range 7/70/ Each referenced PubChem compound corresponds to the full crystal structure. |
7703471.cif |
| 248917 | 2020-03-05 | cif/ Updating files of 7703465, 7703466, 7703467, 7703468, 7703469, 7703470, 7703471, 7703472, 7703473, 7703474 Original log message: Adding full bibliography for 7703465--7703474.cif. |
7703471.cif |
| 247937 | 2020-02-07 | cif/ Adding structures of 7703465, 7703466, 7703467, 7703468, 7703469, 7703470, 7703471, 7703472, 7703473, 7703474 via cif-deposit CGI script. |
7703471.cif |
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Users of the data should acknowledge the original authors of the
structural data.