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Information card for entry 7206354
Preview
| Coordinates | 7206354.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C78 H36 Br24 Cl5 O12 Si8 |
|---|---|
| Calculated formula | C54 H20 Br24 Cl2 O12 Si8 |
| Title of publication | [PhSiO1.5]8 promotes self-bromination to produce [o-BrPhSiO1.5]8: further bromination gives crystalline [2,5-Br2PhSiO1.5]8 with a density of 2.32 g cm−3 and a calculated refractive index of 1.7 or the tetraicosa bromo compound [Br3PhSiO1.5]8 |
| Authors of publication | Roll, Mark F.; Mathur, Priyanka; Takahashi, Kunio; Kampf, Jeffrey W.; Laine, R. M. |
| Journal of publication | Journal of Materials Chemistry |
| Year of publication | 2011 |
| Journal volume | 21 |
| Journal issue | 30 |
| Pages of publication | 11167 |
| a | 15.5726 ± 0.001 Å |
| b | 20.4685 ± 0.0013 Å |
| c | 20.6449 ± 0.0013 Å |
| α | 65.399 ± 0.001° |
| β | 74.616 ± 0.001° |
| γ | 82.172 ± 0.001° |
| Cell volume | 5766.3 ± 0.6 Å3 |
| Cell temperature | 85 ± 2 K |
| Ambient diffraction temperature | 85 ± 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 | 0.0757 |
| Residual factor for significantly intense reflections | 0.0629 |
| Weighted residual factors for significantly intense reflections | 0.1935 |
| Weighted residual factors for all reflections included in the refinement | 0.2024 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.089 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 180394 (current) | 2016-03-26 | cif/7/20/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/20/63. |
7206354.cif |
| 120112 | 2014-07-12 | Adding DOIs to range 7 structures. | 7206354.cif |
| 35909 | 2012-02-26 | cif/7/: reorganising range 7 into a prefix-directory tree. | 7206354.cif |
| 23718 | 2011-08-09 | ../uploads/cif-deposit/cod/cif Adding structures of 7206354, 7206355, 7206356 via cif-deposit CGI script. |
7206354.cif |
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