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Information card for entry 1551161
Preview
| Coordinates | 1551161.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C18 H18 In N3 O8 |
|---|---|
| Calculated formula | C18 H18 In N3 O8 |
| Title of publication | Solvent-switchable continuous-breathing behaviour in a diamoniod metal-organic framework and its influence on CO2 vs CH4 selectivity |
| Authors of publication | Carrington, Elliot J.; McAnally, Craig A.; Fletcher, Ashleigh J.; Thompson, Stephen P.; Warren, Mark; Brammer, Lee |
| Journal of publication | Nature Chemistry |
| Year of publication | 2017 |
| Journal volume | 9 |
| Pages of publication | 882 - 889 |
| a | 15.3069 ± 0.0005 Å |
| b | 26.9467 ± 0.0008 Å |
| c | 31.284 ± 0.001 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 12903.7 ± 0.7 Å3 |
| Cell temperature | 100 K |
| Ambient diffraction temperature | 100 K |
| Number of distinct elements | 5 |
| Space group number | 70 |
| Hermann-Mauguin space group symbol | F d d d |
| Hall space group symbol | -F 2uv 2vw |
| Residual factor for all reflections | 0.061 |
| Residual factor for significantly intense reflections | 0.0523 |
| Weighted residual factors for significantly intense reflections | 0.1834 |
| Weighted residual factors for all reflections included in the refinement | 0.1961 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.204 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 215550 (current) | 2019-05-27 | cif/ Adding structures of 1551161 via cif-deposit CGI script. |
1551161.cif |
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Users of the data should acknowledge the original authors of the
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