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Information card for entry 7133280
Preview
| Coordinates | 7133280.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C52.5 H86 Be Cl N2 O6 Rb Si2 |
|---|---|
| Calculated formula | C49 H82 Be Cl N2 O6 Rb Si2 |
| Title of publication | Alkali metal reduction of crown ether encapsulated alkali metal cations. |
| Authors of publication | Pearce, Kyle G.; Neale, Samuel E.; Mahon, Mary F.; McMullin, Claire L.; Hill, Michael S. |
| Journal of publication | Chemical communications (Cambridge, England) |
| Year of publication | 2024 |
| Journal volume | 60 |
| Journal issue | 64 |
| Pages of publication | 8391 - 8394 |
| a | 16.7051 ± 0.0003 Å |
| b | 21.103 ± 0.0003 Å |
| c | 17.1977 ± 0.0003 Å |
| α | 90° |
| β | 103.361 ± 0.002° |
| γ | 90° |
| Cell volume | 5898.57 ± 0.18 Å3 |
| Cell temperature | 150 ± 2 K |
| Ambient diffraction temperature | 150 ± 2 K |
| Number of distinct elements | 8 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.0629 |
| Residual factor for significantly intense reflections | 0.0508 |
| Weighted residual factors for significantly intense reflections | 0.1266 |
| Weighted residual factors for all reflections included in the refinement | 0.1342 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.025 |
| 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 |
|---|---|---|---|
| 294419 (current) | 2024-09-06 | cif/ Updating files of 7133277, 7133278, 7133279, 7133280, 7133281, 7133282 Original log message: Adding full bibliography for 7133277--7133282.cif. |
7133280.cif |
| 292733 | 2024-07-05 | cif/ Adding structures of 7133277, 7133278, 7133279, 7133280, 7133281, 7133282 via cif-deposit CGI script. |
7133280.cif |
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Users of the data should acknowledge the original authors of the
structural data.