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Information card for entry 1551455
Preview
| Coordinates | 1551455.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Mineral name | NOTT-300 C2D2 |
|---|---|
| Formula | C21.4 H8 Al2 D5.4 O10 |
| Calculated formula | C21.0068 H8 Al2 D5.0068 O10 |
| Title of publication | Supramolecular binding and separation of hydrocarbons within a functionalized porous metal-organic framework |
| Authors of publication | Sihai Yang; Anibal J. Ramirez-Cuesta; Ruth Newby; Victoria Garcia-Sakai; Pascal Manuel; Samantha K. Callear; Stuart I. Campbell; Chiu C. Tang; Martin Schroder |
| Journal of publication | Nature Chemistry |
| Year of publication | 2015 |
| Journal volume | 7 |
| Pages of publication | 121 - 129 |
| a | 14.785355 ± 0.000083 Å |
| b | 14.785355 ± 0.000083 Å |
| c | 11.77396 ± 0.00015 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 2573.87 ± 0.04 Å3 |
| Ambient diffraction temperature | 100 K |
| Number of distinct elements | 5 |
| Space group number | 98 |
| Hermann-Mauguin space group symbol | I 41 2 2 |
| Hall space group symbol | I 4bw 2bw |
| Residual factor R(I) for significantly intense reflections | 0.006 |
| Goodness-of-fit parameter for all reflections included in the refinement | 3.31 |
| Method of determination | powder diffraction |
| Diffraction radiation probe | neutron |
| Diffraction radiation type | ToF |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 216024 (current) | 2019-06-17 | cif/ Adding structures of 1551455 via cif-deposit CGI script. |
1551455.cif |
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