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Information card for entry 2237536
Preview
| Coordinates | 2237536.cif |
|---|---|
| Structure factors | 2237536.hkl |
| Original IUCr paper | HTML |
| Chemical name | <i>catena</i>-Poly[[(tetrahydrofuran-κ<i>O</i>)potassium]-di-μ-dimethylamido-κ^4^<i>N</i>:<i>N</i>-aluminium-di-μ-dimethylamido-κ^4^<i>N</i>:<i>N</i>-potassium-di-μ-dimethylamido-κ^4^<i>N</i>:<i>N</i>-aluminium-di-μ-dimethylamido-κ^4^<i>N</i>:<i>N</i>] |
|---|---|
| Formula | C20 H56 Al2 K2 N8 O |
| Calculated formula | C20 H56 Al2 K2 N8 O |
| SMILES | [Al](N(C)C)(N(C)C)(N(C)C)N(C)C.[K+].[K][O]1CCCC1.[Al](N(C)C)(N(C)C)(N(C)C)N(C)C |
| Title of publication | <i>catena</i>-Poly[[(tetrahydrofuran-κ<i>O</i>)potassium]-di-μ-dimethylamido-κ^4^<i>N</i>:<i>N</i>-aluminium-di-μ-dimethylamido-κ^4^<i>N</i>:<i>N</i>-potassium-di-μ-dimethylamido-κ^4^<i>N</i>:<i>N</i>-aluminium-di-μ-dimethylamido-κ^4^<i>N</i>:<i>N</i>] |
| Authors of publication | Purdy, Andrew; Parrish, Damon |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2013 |
| Journal volume | 69 |
| Journal issue | 3 |
| Pages of publication | m147 |
| a | 13.247 ± 0.004 Å |
| b | 12.075 ± 0.004 Å |
| c | 20.822 ± 0.007 Å |
| α | 90° |
| β | 90.979 ± 0.005° |
| γ | 90° |
| Cell volume | 3330.1 ± 1.9 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173 ± 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 | 0.0475 |
| Residual factor for significantly intense reflections | 0.0361 |
| Weighted residual factors for significantly intense reflections | 0.1005 |
| Weighted residual factors for all reflections included in the refinement | 0.1068 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.027 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/2237536.html
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