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Information card for entry 1552055
Preview
| Coordinates | 1552055.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C72 H35 Cu3 N O15 |
|---|---|
| Calculated formula | C72.5 H35 Cu3 N O15 |
| Title of publication | Discovery and introduction of a (3,18)-connected net as an ideal blueprint for the design of metal-organic frameworks |
| Authors of publication | Vincent Guillerm; Lukasz J. Weselinski; Youssef Belmabkhout; Amy J. Cairns; Valerio D Elia; Lukasz Wojtas; Karim Adil; Mohamed Eddaoudi |
| Journal of publication | Nature Chemistry |
| Year of publication | 2014 |
| Journal volume | 6 |
| Pages of publication | 673 - 680 |
| a | 37.1384 ± 0.0013 Å |
| b | 37.1384 ± 0.0013 Å |
| c | 74.478 ± 0.004 Å |
| α | 90° |
| β | 90° |
| γ | 120° |
| Cell volume | 88962 ± 6 Å3 |
| Cell temperature | 150 ± 2 K |
| Ambient diffraction temperature | 150 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 194 |
| Hermann-Mauguin space group symbol | P 63/m m c |
| Hall space group symbol | -P 6c 2c |
| Residual factor for all reflections | 0.0969 |
| Residual factor for significantly intense reflections | 0.0638 |
| Weighted residual factors for significantly intense reflections | 0.1697 |
| Weighted residual factors for all reflections included in the refinement | 0.1846 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.02 |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 216873 (current) | 2019-07-09 | cif/ Adding structures of 1552055 via cif-deposit CGI script. |
1552055.cif |
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Users of the data should acknowledge the original authors of the
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