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Information card for entry 8106792
Preview
| Coordinates | 8106792.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C14 H6 Cl4 O3 |
|---|---|
| Calculated formula | C14 H6 Cl4 O3 |
| Title of publication | Crystal structure of 2,4-dichlorobenzene anhydride, C14H6Cl4O3 |
| Authors of publication | Qu, Hai-Tao; Fu, Ying; Ye, Fei |
| Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
| Year of publication | 2016 |
| Journal volume | 231 |
| Journal issue | 1 |
| Pages of publication | 85 - 86 |
| a | 11.884 ± 0.002 Å |
| b | 11.902 ± 0.002 Å |
| c | 10.509 ± 0.002 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 1486.4 ± 0.5 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 56 |
| Hermann-Mauguin space group symbol | P c c n |
| Hall space group symbol | -P 2ab 2ac |
| Residual factor for all reflections | 0.0542 |
| Residual factor for significantly intense reflections | 0.044 |
| Weighted residual factors for significantly intense reflections | 0.1047 |
| Weighted residual factors for all reflections included in the refinement | 0.1106 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.096 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 281206 (current) | 2023-03-01 | cif/ Adding structures of 8106792 via cif-deposit CGI script. |
8106792.cif |
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Users of the data should acknowledge the original authors of the
structural data.