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Information card for entry 8107308
Preview
| Coordinates | 8107308.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C16 H14 Cl2 O6 |
|---|---|
| Calculated formula | C16 H14 Cl2 O6 |
| Title of publication | The crystal structure of 3,7-dihydroxy-9-methoxy-4a-methyl-4aH-benzo[c] chromene-2,6-dione —dichloromethane (1/1), C16H14Cl2O6 |
| Authors of publication | Liu, Juan; Chen, Sai; Wang, Meng; Yuan, Wei-Hua; Li, Honglei |
| Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
| Year of publication | 2022 |
| Journal volume | 237 |
| Journal issue | 6 |
| Pages of publication | 1117 - 1118 |
| a | 8.9847 ± 0.0019 Å |
| b | 18.284 ± 0.004 Å |
| c | 11.107 ± 0.003 Å |
| α | 90° |
| β | 115.942 ± 0.002° |
| γ | 90° |
| Cell volume | 1640.8 ± 0.7 Å3 |
| Cell temperature | 273 ± 2 K |
| Ambient diffraction temperature | 273.15 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 | 0.061 |
| Residual factor for significantly intense reflections | 0.0473 |
| Weighted residual factors for significantly intense reflections | 0.1248 |
| Weighted residual factors for all reflections included in the refinement | 0.1358 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.04 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 284400 (current) | 2023-06-08 | cif/ Adding structures of 8107308 via cif-deposit CGI script. |
8107308.cif |
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Users of the data should acknowledge the original authors of the
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