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Information card for entry 7705379
Preview
| Coordinates | 7705379.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C20 H28 F12 N2 O6 Sr |
|---|---|
| Calculated formula | C20 H28 F12 N2 O6 Sr |
| Title of publication | Alkaline-earth complexes with macrocyclic-functionalised bis(phenolate)s and bis(fluoroalkoxide)s. |
| Authors of publication | Hammoud, Joanna; Abou-Khalil, Fatima; Roisnel, Thierry; Dorcet, Vincent; Bour, Christophe; Gandon, Vincent; Lebœuf, David; Carpentier, Jean-François; Sarazin, Yann |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2020 |
| Journal volume | 49 |
| Journal issue | 37 |
| Pages of publication | 13017 - 13028 |
| a | 21.6408 ± 0.0016 Å |
| b | 8.7328 ± 0.0008 Å |
| c | 14.8071 ± 0.0013 Å |
| α | 90° |
| β | 112.57 ± 0.003° |
| γ | 90° |
| Cell volume | 2584 ± 0.4 Å3 |
| Cell temperature | 150 ± 2 K |
| Ambient diffraction temperature | 150 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for all reflections | 0.0208 |
| Residual factor for significantly intense reflections | 0.0187 |
| Weighted residual factors for significantly intense reflections | 0.0461 |
| Weighted residual factors for all reflections included in the refinement | 0.0469 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.066 |
| 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 |
|---|---|---|---|
| 301878 (current) | 2025-08-23 | Add cross-references to PubChem compounds in COD range 7/70/ Each referenced PubChem compound corresponds to the full crystal structure. |
7705379.cif |
| 257509 | 2020-10-06 | cif/ Updating files of 7705378, 7705379, 7705380, 7705381, 7705382, 7705383, 7705384, 7705385, 7705386, 7705387, 7705388, 7705389 Original log message: Adding full bibliography for 7705378--7705389.cif. |
7705379.cif |
| 256215 | 2020-09-08 | cif/ Adding structures of 7705378, 7705379, 7705380, 7705381, 7705382, 7705383, 7705384, 7705385, 7705386, 7705387, 7705388, 7705389 via cif-deposit CGI script. |
7705379.cif |
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Users of the data should acknowledge the original authors of the
structural data.