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Information card for entry 1548524
Preview
| Coordinates | 1548524.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C3 H12 Al3 F N O13 P3 |
|---|---|
| Calculated formula | C3 H10 Al3 F N O13 P3 |
| Title of publication | Origin of the structure-directing effect resulting in identical topological open-framework materials |
| Authors of publication | Liang Xin; Huai Sun; Ruren Xu; Wenfu Yan |
| Journal of publication | Scientific Reports |
| Year of publication | 2015 |
| Journal volume | 5 |
| Pages of publication | 14940 |
| a | 9.1231 ± 0.0014 Å |
| b | 9.2411 ± 0.0014 Å |
| c | 9.3426 ± 0.0015 Å |
| α | 86.769 ± 0.004° |
| β | 79.946 ± 0.004° |
| γ | 87.846 ± 0.004° |
| Cell volume | 774 ± 0.2 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 7 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0933 |
| Residual factor for significantly intense reflections | 0.056 |
| Weighted residual factors for significantly intense reflections | 0.1298 |
| Weighted residual factors for all reflections included in the refinement | 0.1453 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.96 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 204443 (current) | 2017-12-21 | cif/ Adding structures of 1548524 via cif-deposit CGI script. |
1548524.cif |
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Users of the data should acknowledge the original authors of the
structural data.