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Information card for entry 4003365
Preview
| Coordinates | 4003365.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C276 H180 Cu24 N24 O144 |
|---|---|
| Calculated formula | C276 H180 Cu24 N24 O144 |
| Title of publication | Mechanochemical Synthesis of Porous Molecular Assemblies |
| Authors of publication | Barreda, Omar; Taggart, Garrett A.; Rowland, Casey A.; Yap, Glenn P. A.; Bloch, Eric D. |
| Journal of publication | Chemistry of Materials |
| Year of publication | 2018 |
| Journal volume | 30 |
| Journal issue | 12 |
| Pages of publication | 3975 |
| a | 32.5662 ± 0.0017 Å |
| b | 32.5662 ± 0.0017 Å |
| c | 46.87 ± 0.002 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 49708 ± 4 Å3 |
| Cell temperature | 200 ± 2 K |
| Ambient diffraction temperature | 200 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 87 |
| Hermann-Mauguin space group symbol | I 4/m |
| Hall space group symbol | -I 4 |
| Residual factor for all reflections | 0.1446 |
| Residual factor for significantly intense reflections | 0.1325 |
| Weighted residual factors for significantly intense reflections | 0.3954 |
| Weighted residual factors for all reflections included in the refinement | 0.4118 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.953 |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 231539 (current) | 2019-11-22 | cif/ Adding structures of 4003365 via cif-deposit CGI script. |
4003365.cif |
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Users of the data should acknowledge the original authors of the
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