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Information card for entry 7716100
Preview
| Coordinates | 7716100.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C8 H2 O2 S4 |
|---|---|
| Calculated formula | C8 H2 O2 S4 |
| Title of publication | Radical and diradical states of bis(molybdenocene dithiolene) complexes. |
| Authors of publication | Youssef, Khalil; Poidevin, Corentin; Vacher, Antoine; Fihey, Arnaud; Le Gal, Yann; Roisnel, Thierry; Lorcy, Dominique |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2024 |
| Journal volume | 53 |
| Journal issue | 23 |
| Pages of publication | 9763 - 9776 |
| a | 3.8723 ± 0.0007 Å |
| b | 11.708 ± 0.002 Å |
| c | 9.9274 ± 0.0017 Å |
| α | 90° |
| β | 90.31 ± 0.007° |
| γ | 90° |
| Cell volume | 450.07 ± 0.14 Å3 |
| Cell temperature | 150 ± 2 K |
| Ambient diffraction temperature | 150 ± 2 K |
| Number of distinct elements | 4 |
| 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 | 0.0376 |
| Residual factor for significantly intense reflections | 0.0344 |
| Weighted residual factors for significantly intense reflections | 0.0826 |
| Weighted residual factors for all reflections included in the refinement | 0.0846 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.017 |
| 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 |
|---|---|---|---|
| 293134 (current) | 2024-07-05 | cif/ Updating files of 7716097, 7716098, 7716099, 7716100, 7716101, 7716102, 7716103, 7716104 Original log message: Adding full bibliography for 7716097--7716104.cif. |
7716100.cif |
| 291972 | 2024-05-22 | cif/ Adding structures of 7716097, 7716098, 7716099, 7716100, 7716101, 7716102, 7716103, 7716104 via cif-deposit CGI script. |
7716100.cif |
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Users of the data should acknowledge the original authors of the
structural data.