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Information card for entry 7121313
Preview
| Coordinates | 7121313.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C38.98 H61.83 Ni P2 S Si |
|---|---|
| Calculated formula | C38.977 H61.8247 Ni P2 S Si |
| Title of publication | Synthesis, crystal structure and reactivity of η<sup>2</sup>-thiophyne Ni complexes. |
| Authors of publication | Terada, Misaki; Nishii, Yuji; Miura, Masahiro |
| Journal of publication | Chemical communications (Cambridge, England) |
| Year of publication | 2018 |
| Journal volume | 54 |
| Journal issue | 23 |
| Pages of publication | 2918 - 2921 |
| a | 10.9627 ± 0.0002 Å |
| b | 15.9681 ± 0.0003 Å |
| c | 35.1062 ± 0.0004 Å |
| α | 82.137 ± 0.001° |
| β | 82.667 ± 0.001° |
| γ | 83.181 ± 0.002° |
| Cell volume | 6005.73 ± 0.17 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173 ± 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 | 0.0838 |
| Residual factor for significantly intense reflections | 0.0632 |
| Weighted residual factors for significantly intense reflections | 0.1585 |
| Weighted residual factors for all reflections included in the refinement | 0.1722 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.01 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 228452 (current) | 2019-11-17 | cif/ Updating files of 7121308, 7121309, 7121310, 7121311, 7121312, 7121313, 7121314 Original log message: Adding full bibliography for 7121308--7121314.cif. |
7121313.cif |
| 206631 | 2018-02-24 | cif/ Adding structures of 7121308, 7121309, 7121310, 7121311, 7121312, 7121313, 7121314 via cif-deposit CGI script. |
7121313.cif |
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Users of the data should acknowledge the original authors of the
structural data.