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Information card for entry 8104724
Preview
| Coordinates | 8104724.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C18 H20 Br2 N4 O8 S2 |
|---|---|
| Calculated formula | C18 H20 Br2 N4 O8 S2 |
| Title of publication | The crystal structure of 6,6′-((1E,1′E)-hydrazine-1,2-diylidenebis(methaneylylidene)) bis(2-bromo-4-nitrophenol) — dimethylsulfoxide (1/2), C14H8Br2N4O6⋅2(C2H6OS) |
| Authors of publication | Ma, Ling; Yang, Ruoqi; Li, Jianqing |
| Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
| Year of publication | 2021 |
| Journal volume | 236 |
| Journal issue | 4 |
| Pages of publication | 823 - 825 |
| a | 6.1463 ± 0.0012 Å |
| b | 8.3637 ± 0.0016 Å |
| c | 12.461 ± 0.003 Å |
| α | 85.578 ± 0.005° |
| β | 85.942 ± 0.005° |
| γ | 86.31 ± 0.005° |
| Cell volume | 635.9 ± 0.2 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.1261 |
| Residual factor for significantly intense reflections | 0.0601 |
| Weighted residual factors for significantly intense reflections | 0.0848 |
| Weighted residual factors for all reflections included in the refinement | 0.0983 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.055 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 273601 (current) | 2022-03-10 | cif/ Adding structures of 8104724 via cif-deposit CGI script. |
8104724.cif |
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Users of the data should acknowledge the original authors of the
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