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Information card for entry 2021747
Preview
| Coordinates | 2021747.cif |
|---|---|
| Structure factors | 2021747.hkl |
| Original IUCr paper | HTML |
| Chemical name | Poly[[bis(dimethylformamide)(μ~6~-4,4',4''-{[(2,4,6-trimethylbenzene-1,3,5-triyl)tris(methylene)]tris(oxy)}tribenzoato)lanthanum(III)] dimethylformamide tetrasolvate 0.25-hydrate] |
|---|---|
| Formula | C51 H69.5 La N6 O15.25 |
| Calculated formula | C51 H69.5 La N6 O15.25 |
| Title of publication | A new lanthanum coordination polymer built from a semi-rigid tripodal carboxylic acid ligand: synthesis, crystal structure and properties |
| Authors of publication | Zhou, Lian; Shi, Pei-Dong; Guo, Xiao-Kun; Feng, Xiu-Cun; Wang, Lin-Lin; Zhang, Jun |
| Journal of publication | Acta Crystallographica Section C |
| Year of publication | 2019 |
| Journal volume | 75 |
| Journal issue | 9 |
| a | 12.947 ± 0.003 Å |
| b | 13.889 ± 0.003 Å |
| c | 16.289 ± 0.0011 Å |
| α | 77.482 ± 0.003° |
| β | 73.859 ± 0.003° |
| γ | 85.101 ± 0.002° |
| Cell volume | 2745.8 ± 0.9 Å3 |
| Cell temperature | 291 ± 2 K |
| Ambient diffraction temperature | 291.15 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0698 |
| Residual factor for significantly intense reflections | 0.0599 |
| Weighted residual factors for significantly intense reflections | 0.145 |
| Weighted residual factors for all reflections included in the refinement | 0.147 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.014 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 217608 (current) | 2019-08-20 | cif/ hkl/ Adding structures of 2021747 via cif-deposit CGI script. |
2021747.cif 2021747.hkl |
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Users of the data should acknowledge the original authors of the
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