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Information card for entry 4003290
Preview
| Coordinates | 4003290.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C14.45 H8 O6.89 Pb S |
|---|---|
| Calculated formula | C14.447 H8 O6.894 Pb S |
| Title of publication | Understanding The Fascinating Origins of CO2 Adsorption and Dynamics in MOFs |
| Authors of publication | Chen, Shoushun; Lucier, Bryan E.G.; Boyle, Paul D.; Huang, Yining |
| Journal of publication | Chemistry of Materials |
| Year of publication | 2016 |
| Journal volume | 28 |
| Journal issue | 16 |
| Pages of publication | 5829 |
| a | 5.8815 ± 0.0016 Å |
| b | 13.035 ± 0.003 Å |
| c | 19.371 ± 0.004 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 1485.1 ± 0.6 Å3 |
| Cell temperature | 110 K |
| Ambient diffraction temperature | 110 K |
| Number of distinct elements | 5 |
| Space group number | 62 |
| Hermann-Mauguin space group symbol | P n m a |
| Hall space group symbol | -P 2ac 2n |
| Residual factor for all reflections | 0.0385 |
| Residual factor for significantly intense reflections | 0.0249 |
| Weighted residual factors for significantly intense reflections | 0.0404 |
| Weighted residual factors for all reflections included in the refinement | 0.0431 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.04 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 231494 (current) | 2019-11-22 | cif/ Adding structures of 4003290 via cif-deposit CGI script. |
4003290.cif |
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Users of the data should acknowledge the original authors of the
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