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Information card for entry 8104996
Preview
| Coordinates | 8104996.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C8 H3 Br O4 Zn |
|---|---|
| Calculated formula | C8 H3 Br O4 Zn |
| Title of publication | The crystal structure of poly[(m4-4-bromoisophthalato-κ4O: O′:O′′:O′′′)zinc(II)], C8H3BrO4Zn |
| Authors of publication | Chang, Xin-Hong |
| Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
| Year of publication | 2019 |
| Journal volume | 235 |
| Journal issue | 1 |
| Pages of publication | 3 - 4 |
| a | 4.7134 ± 0.0004 Å |
| b | 15.4354 ± 0.0013 Å |
| c | 12.0064 ± 0.0009 Å |
| α | 90° |
| β | 98.942 ± 0.008° |
| γ | 90° |
| Cell volume | 862.89 ± 0.12 Å3 |
| Cell temperature | 292.67 ± 0.1 K |
| Ambient diffraction temperature | 292.67 ± 0.1 K |
| Number of distinct elements | 5 |
| 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 | 0.0544 |
| Residual factor for significantly intense reflections | 0.0445 |
| Weighted residual factors for significantly intense reflections | 0.1113 |
| Weighted residual factors for all reflections included in the refinement | 0.1193 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.0371 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 274209 (current) | 2022-04-01 | cif/ Adding structures of 8104996 via cif-deposit CGI script. |
8104996.cif |
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Users of the data should acknowledge the original authors of the
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