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Information card for entry 1563841
Preview
| Coordinates | 1563841.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C10 H23 N2 O2 P |
|---|---|
| Calculated formula | C10 H23 N2 O2 P |
| SMILES | P12(OC[C@@H](N1)C(C)C)OC[C@@H](N2)C(C)C |
| Title of publication | From bidentate H-spirophosporane ligand to tridentate phosphonate ligand in palladium chemistry |
| Authors of publication | Skarżyńska, Anna; Gniewek, Andrzej |
| Journal of publication | Inorganica Chimica Acta |
| Year of publication | 2018 |
| Journal volume | 483 |
| Pages of publication | 248 - 251 |
| a | 11.855 ± 0.004 Å |
| b | 11.855 ± 0.004 Å |
| c | 18.922 ± 0.005 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 2659.3 ± 1.5 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 92 |
| Hermann-Mauguin space group symbol | P 41 21 2 |
| Hall space group symbol | P 4abw 2nw |
| Residual factor for all reflections | 0.0472 |
| Residual factor for significantly intense reflections | 0.0365 |
| Weighted residual factors for significantly intense reflections | 0.0739 |
| Weighted residual factors for all reflections included in the refinement | 0.0767 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.022 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 266863 (current) | 2021-07-01 | cif/ Adding structures of 1563841, 1563842 via cif-deposit CGI script. |
1563841.cif |
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Users of the data should acknowledge the original authors of the
structural data.