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Information card for entry 4517349
Preview
| Coordinates | 4517349.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C70 H106 F12 P2 Ru2 S12 |
|---|---|
| Calculated formula | C70 H106 F12 P2 Ru2 S12 |
| Title of publication | Synthesis and Reactivity of Cyclopentadienyl Ruthenium(II) Complexes with Tris(alkylthio)benzenes: Transformation between Dinuclear and Sandwich-Type Complexes |
| Authors of publication | Fan, Rong; Sumitani, Ryo; Mochida, Tomoyuki |
| Journal of publication | ACS Omega |
| Year of publication | 2020 |
| a | 10.8307 ± 0.0009 Å |
| b | 13.7904 ± 0.0012 Å |
| c | 15.3733 ± 0.0013 Å |
| α | 107.399 ± 0.001° |
| β | 96.927 ± 0.001° |
| γ | 108.983 ± 0.001° |
| Cell volume | 2010.6 ± 0.3 Å3 |
| Cell temperature | 90 ± 2 K |
| Ambient diffraction temperature | 90 ± 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 | 0.047 |
| Residual factor for significantly intense reflections | 0.0421 |
| Weighted residual factors for significantly intense reflections | 0.1108 |
| Weighted residual factors for all reflections included in the refinement | 0.1168 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.067 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 247216 (current) | 2020-01-25 | cif/ Adding structures of 4517349 via cif-deposit CGI script. |
4517349.cif |
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