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Information card for entry 8105241
Preview
| Coordinates | 8105241.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C15 H9 F O3 |
|---|---|
| Calculated formula | C15 H9 F O3 |
| Title of publication | Crystal structure of 4-(3-fluorophenyl)-7-hydroxy-2H-chromen-2-one, C15H9FO3 |
| Authors of publication | Mzozoyana, Vuyisa; Zamisa, Sizwe J. |
| Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
| Year of publication | 2020 |
| Journal volume | 235 |
| Journal issue | 3 |
| Pages of publication | 631 - 633 |
| a | 20.3523 ± 0.0017 Å |
| b | 11.2575 ± 0.0009 Å |
| c | 10.1604 ± 0.0008 Å |
| α | 90° |
| β | 104.434 ± 0.001° |
| γ | 90° |
| Cell volume | 2254.4 ± 0.3 Å3 |
| Cell temperature | 100 K |
| Ambient diffraction temperature | 100 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 | 0.0376 |
| Residual factor for significantly intense reflections | 0.034 |
| Weighted residual factors for significantly intense reflections | 0.093 |
| Weighted residual factors for all reflections included in the refinement | 0.0961 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.057 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 275396 (current) | 2022-05-13 | cif/ Adding structures of 8105241 via cif-deposit CGI script. |
8105241.cif |
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