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Information card for entry 4004045
Preview
| Coordinates | 4004045.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C41 H18 Cu2 N2 O11 |
|---|---|
| Calculated formula | C40.5 H18 Cu2 N O11 |
| Title of publication | Integration of Fluorescent Functionality into Pressure-Amplifying Metal–Organic Frameworks |
| Authors of publication | Walenszus, Francesco; Evans, Jack D.; Bon, Volodymyr; Schwotzer, Friedrich; Senkovska, Irena; Kaskel, Stefan |
| Journal of publication | Chemistry of Materials |
| Year of publication | 2021 |
| Journal volume | 33 |
| Journal issue | 20 |
| Pages of publication | 7964 - 7971 |
| a | 46.14 ± 0.005 Å |
| b | 46.14 ± 0.005 Å |
| c | 46.14 ± 0.005 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 98227 ± 18 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 225 |
| Hermann-Mauguin space group symbol | F m -3 m |
| Hall space group symbol | -F 4 2 3 |
| Residual factor for all reflections | 0.107 |
| Residual factor for significantly intense reflections | 0.0809 |
| Weighted residual factors for significantly intense reflections | 0.2426 |
| Weighted residual factors for all reflections included in the refinement | 0.2888 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.148 |
| Diffraction radiation wavelength | 0.895 Å |
| Diffraction radiation type | synchrotron |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 270264 (current) | 2021-11-04 | cif/ Adding structures of 4004045, 4004046, 4004047 via cif-deposit CGI script. |
4004045.cif |
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Users of the data should acknowledge the original authors of the
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