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Information card for entry 7233133
Preview
| Coordinates | 7233133.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C19 H25 N O4 |
|---|---|
| Calculated formula | C19 H25 N O4 |
| Title of publication | Self-assembly of bis-β-diketone-based [M2L2] dinuclear platforms into 2-dimensional coordination polymers |
| Authors of publication | Brock, A. J.; McMurtrie, John C.; Clegg, J. K. |
| Journal of publication | CrystEngComm |
| Year of publication | 2019 |
| Journal volume | 21 |
| Journal issue | 32 |
| Pages of publication | 4786 |
| a | 6.2281 ± 0.0005 Å |
| b | 19.4672 ± 0.0019 Å |
| c | 15.2664 ± 0.0013 Å |
| α | 90° |
| β | 95.993 ± 0.008° |
| γ | 90° |
| Cell volume | 1840.8 ± 0.3 Å3 |
| Cell temperature | 190 ± 2 K |
| Ambient diffraction temperature | 190 ± 2 K |
| Number of distinct elements | 4 |
| 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 | 0.0729 |
| Residual factor for significantly intense reflections | 0.0533 |
| Weighted residual factors for significantly intense reflections | 0.1489 |
| Weighted residual factors for all reflections included in the refinement | 0.1692 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.051 |
| 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 |
|---|---|---|---|
| 301866 (current) | 2025-08-23 | Add cross-references to PubChem compounds in COD range 7/23/ Each referenced PubChem compound corresponds to the full crystal structure. |
7233133.cif |
| 223514 | 2019-11-07 | cif/ Updating files of 7233133, 7233134, 7233135, 7233136 Original log message: Adding full bibliography for 7233133--7233136.cif. |
7233133.cif |
| 217046 | 2019-07-16 | cif/ Adding structures of 7233133, 7233134, 7233135, 7233136 via cif-deposit CGI script. |
7233133.cif |
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Users of the data should acknowledge the original authors of the
structural data.