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Information card for entry 1507798
Preview
| Coordinates | 1507798.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | MOF326, SQUEEZED refinement |
|---|---|
| Formula | C48 H72 B6 N12 O13 Zn4 |
| Calculated formula | C48 H72 B6 N12 O13 Zn4 |
| Title of publication | Hydrogen Storage in New Metal‒Organic Frameworks |
| Authors of publication | Tranchemontagne, David J.; Park, Kyo Sung; Furukawa, Hiroyasu; Eckert, Juergen; Knobler, Carolyn B.; Yaghi, Omar M. |
| Journal of publication | The Journal of Physical Chemistry C |
| Year of publication | 2012 |
| Journal volume | 116 |
| Journal issue | 24 |
| Pages of publication | 13143 |
| a | 33.41 ± 0.004 Å |
| b | 33.41 ± 0.004 Å |
| c | 33.41 ± 0.004 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 37293 ± 8 Å3 |
| Cell temperature | 258 ± 2 K |
| Ambient diffraction temperature | 258 ± 2 K |
| Number of distinct elements | 6 |
| 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 | 0.1335 |
| Residual factor for significantly intense reflections | 0.0829 |
| Weighted residual factors for significantly intense reflections | 0.2551 |
| Weighted residual factors for all reflections included in the refinement | 0.2846 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.974 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
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