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Information card for entry 1559274
Preview
| Coordinates | 1559274.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | UiO-67-Me~2~ |
|---|---|
| Formula | C96 O40 Zr6 |
| Calculated formula | C96 O40 Zr6 |
| Title of publication | Twinning in Zr-Based Metal-Organic Framework Crystals |
| Authors of publication | Øien-Ødegaard, Sigurd; Lillerud, Karl |
| Journal of publication | Chemistry |
| Year of publication | 2020 |
| Journal volume | 2 |
| Journal issue | 3 |
| Pages of publication | 777 - 786 |
| a | 26.8903 ± 0.0012 Å |
| b | 26.8903 ± 0.0012 Å |
| c | 26.8903 ± 0.0012 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 19444.1 ± 1.5 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 99.99 K |
| Number of distinct elements | 3 |
| Space group number | 225 |
| Hermann-Mauguin space group symbol | F m -3 m |
| Hall space group symbol | -F 4 2 3 |
| Residual factor for all reflections | 0.0531 |
| Residual factor for significantly intense reflections | 0.0479 |
| Weighted residual factors for significantly intense reflections | 0.1686 |
| Weighted residual factors for all reflections included in the refinement | 0.1743 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.127 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 258172 (current) | 2020-10-06 | cif/ Adding structures of 1559274 via cif-deposit CGI script. |
1559274.cif |
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