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Information card for entry 7047686
Preview
| Coordinates | 7047686.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C49 H41 N5 Se4 Th |
|---|---|
| Calculated formula | C49 H41 N5 Se4 Th |
| Title of publication | Monomeric thorium chalcogenolates with bipyridine and terpyridine ligands. |
| Authors of publication | Ringgold, Marissa; Wu, Wen; Stuber, Matthew; Kornienko, Anna Y.; Emge, Thomas J.; Brennan, John G. |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2018 |
| Journal volume | 47 |
| Journal issue | 41 |
| Pages of publication | 14652 - 14661 |
| a | 20.895 ± 0.002 Å |
| b | 9.4734 ± 0.0011 Å |
| c | 22.815 ± 0.003 Å |
| α | 90° |
| β | 100.916 ± 0.0014° |
| γ | 90° |
| Cell volume | 4434.4 ± 0.9 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 5 |
| 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 | 0.0572 |
| Residual factor for significantly intense reflections | 0.0404 |
| Weighted residual factors for significantly intense reflections | 0.0879 |
| Weighted residual factors for all reflections included in the refinement | 0.0952 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.03 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301850 (current) | 2025-08-21 | Add cross-references to PubChem compounds in COD range 7/04/ Each referenced PubChem compound corresponds to the full crystal structure. |
7047686.cif |
| 229342 | 2019-11-17 | cif/ Updating files of 7047683, 7047684, 7047685, 7047686, 7047687 Original log message: Adding full bibliography for 7047683--7047687.cif. |
7047686.cif |
| 211288 | 2018-10-03 | cif/ Adding structures of 7047683, 7047684, 7047685, 7047686, 7047687 via cif-deposit CGI script. |
7047686.cif |
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Users of the data should acknowledge the original authors of the
structural data.