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Information card for entry 1563957
Preview
| Coordinates | 1563957.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Chemical name | MOF-711 |
|---|---|
| Formula | C16 H8 O16 Zr3 |
| Calculated formula | C16 H8 O15.941 Zr3 |
| Title of publication | 'Eye' of the molecule-a viewpoint. |
| Authors of publication | Lee, Seungkyu; Yaghi, Omar M. |
| Journal of publication | Faraday discussions |
| Year of publication | 2021 |
| Journal volume | 231 |
| Journal issue | 0 |
| Pages of publication | 145 - 149 |
| a | 13.4687 ± 0.0015 Å |
| b | 14.8959 ± 0.0017 Å |
| c | 21.264 ± 0.002 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 4266.2 ± 0.8 Å3 |
| Cell temperature | 100 K |
| Ambient diffraction temperature | 100 K |
| Number of distinct elements | 4 |
| Space group number | 58 |
| Hermann-Mauguin space group symbol | P n n m |
| Hall space group symbol | -P 2 2n |
| Residual factor for all reflections | 0.0522 |
| Residual factor for significantly intense reflections | 0.041 |
| Weighted residual factors for significantly intense reflections | 0.1068 |
| Weighted residual factors for all reflections included in the refinement | 0.1111 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.999 |
| Diffraction radiation wavelength | 0.7749 Å |
| Diffraction radiation type | synchrotron |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 270455 (current) | 2021-11-06 | cif/ Updating files of 1563957 Original log message: Adding full bibliography for 1563957.cif. |
1563957.cif |
| 267264 | 2021-07-06 | cif/ Adding structures of 1563957 via cif-deposit CGI script. |
1563957.cif |
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