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Information card for entry 2312123
Preview
| Coordinates | 2312123.cif |
|---|---|
| Structure factors | 2312123.hkl |
| Original IUCr paper | HTML |
| Formula | C18 H16 O Si |
|---|---|
| Calculated formula | C18 H16 O Si |
| Title of publication | Unusual flash cooling-induced phase in a crystal of triphenylsilanol. |
| Authors of publication | Krawczyk, Monika K. |
| Journal of publication | Acta crystallographica Section B, Structural science, crystal engineering and materials |
| Year of publication | 2023 |
| Journal volume | 79 |
| Journal issue | 3 |
| Pages of publication | 245 - 251 |
| a | 15.025 ± 0.002 Å |
| b | 19.506 ± 0.002 Å |
| c | 23.021 ± 0.002 Å |
| α | 107.96 ± 0.02° |
| β | 102.68 ± 0.02° |
| γ | 101.48 ± 0.02° |
| Cell volume | 5997.5 ± 1.8 Å3 |
| Cell temperature | 80 ± 2 K |
| Ambient diffraction temperature | 80 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 1 |
| Hermann-Mauguin space group symbol | P 1 |
| Hall space group symbol | P 1 |
| Residual factor for all reflections | 0.0525 |
| Residual factor for significantly intense reflections | 0.0483 |
| Weighted residual factors for significantly intense reflections | 0.1383 |
| Weighted residual factors for all reflections included in the refinement | 0.1428 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.118 |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 284366 (current) | 2023-06-06 | cif/ Updating files of 2312118, 2312119, 2312120, 2312121, 2312122, 2312123, 2312124 Original log message: Adding full bibliography for 2312118--2312124.cif. |
2312123.cif 2312123.hkl |
| 284085 | 2023-05-31 | cif/ hkl/ Adding structures of 2312118, 2312119, 2312120, 2312121, 2312122, 2312123, 2312124 via cif-deposit CGI script. |
2312123.cif 2312123.hkl |
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Users of the data should acknowledge the original authors of the
structural data.