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Information card for entry 7123232
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| Coordinates | 7123232.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C62 H33 Co F3 N12 O8 Ru |
|---|---|
| Calculated formula | C60 H33 Co N12 O6 Ru |
| Title of publication | Light-harvesting, 3rd generation MOF with large, tubular channel aperture |
| Authors of publication | Schmitt, Wolfgang; Martins, Luana; Macreadie, Lauren; Sensharma, Debobroto; Vaesen, Sebastien; Zhang, Xia; Gough, John; O'Doherty, Mariah; Zhu, Nianyong; Ruether, Manuel; O'Brien, John E; Bradley, A. Louise |
| Journal of publication | Chemical Communications |
| Year of publication | 2019 |
| a | 26.645 ± 0.004 Å |
| b | 26.645 ± 0.004 Å |
| c | 10.542 ± 0.002 Å |
| α | 90° |
| β | 90° |
| γ | 120° |
| Cell volume | 6481.6 ± 1.8 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 7 |
| Space group number | 163 |
| Hermann-Mauguin space group symbol | P -3 1 c |
| Hall space group symbol | -P 3 2c |
| Residual factor for all reflections | 0.1736 |
| Residual factor for significantly intense reflections | 0.101 |
| Weighted residual factors for significantly intense reflections | 0.237 |
| Weighted residual factors for all reflections included in the refinement | 0.28 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.056 |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 214417 (current) | 2019-03-30 | cif/ Adding structures of 7123232 via cif-deposit CGI script. |
7123232.cif |
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