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Information card for entry 7059020
Preview
| Coordinates | 7059020.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C38 H22 Br2 Fe2 N4 O6 Ru2 |
|---|---|
| Calculated formula | C38 H22 Br2 Fe2 N4 O6 Ru2 |
| Title of publication | Activation reactions of 2-pyridyl and 2-pyrimidinyl alkynes with Ru3(CO)12 |
| Authors of publication | Li, Shasha; Xu, Lei; Jiang, Liping; Zhang, Guofang; Zhang, Wei-Qiang; Gao, Ziwei |
| Journal of publication | New Journal of Chemistry |
| Year of publication | 2019 |
| a | 10.3905 ± 0.0015 Å |
| b | 13.625 ± 0.002 Å |
| c | 14.473 ± 0.002 Å |
| α | 114.58 ± 0.005° |
| β | 95.293 ± 0.005° |
| γ | 99.218 ± 0.005° |
| Cell volume | 1810.2 ± 0.5 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 2 K |
| Number of distinct elements | 7 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0259 |
| Residual factor for significantly intense reflections | 0.0215 |
| Weighted residual factors for significantly intense reflections | 0.0505 |
| Weighted residual factors for all reflections included in the refinement | 0.0526 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.042 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 225388 (current) | 2019-11-08 | cif/ Adding structures of 7059020, 7059021, 7059022, 7059023, 7059024, 7059025, 7059026, 7059027, 7059028, 7059029 via cif-deposit CGI script. |
7059020.cif |
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Users of the data should acknowledge the original authors of the
structural data.