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Information card for entry 1552073
Preview
| Coordinates | 1552073.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C28 H25.75 In Li0.75 O13.75 |
|---|---|
| Calculated formula | C28 H14 In Li0.5 O9 |
| Title of publication | Cation-induced kinetic trapping and enhanced hydrogen adsorption in a modulated anionic metal-organic framework |
| Authors of publication | Sihai Yang; Xiang Lin; Alexander J. Blake; Gavin S. Walker; Peter Hubberstey; Neil R. Champness; Martin Schroder |
| Journal of publication | Nature Chemistry |
| Year of publication | 2009 |
| Journal volume | 1 |
| Pages of publication | 487 - 493 |
| a | 36.5845 ± 0.0012 Å |
| b | 9.7589 ± 0.0003 Å |
| c | 19.6525 ± 0.0006 Å |
| α | 90° |
| β | 103.558 ± 0.002° |
| γ | 90° |
| Cell volume | 6820.9 ± 0.4 Å3 |
| Cell temperature | 120 ± 2 K |
| Ambient diffraction temperature | 120 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for all reflections | 0.111 |
| Residual factor for significantly intense reflections | 0.085 |
| Weighted residual factors for significantly intense reflections | 0.197 |
| Weighted residual factors for all reflections included in the refinement | 0.209 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.06 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 216891 (current) | 2019-07-09 | cif/ Adding structures of 1552073 via cif-deposit CGI script. |
1552073.cif |
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Users of the data should acknowledge the original authors of the
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