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Information card for entry 7709807
Preview
| Coordinates | 7709807.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C28 H40 B0.33 Cu F6.33 N4 Si2.83 |
|---|---|
| Calculated formula | C26 H32 B0.346667 Cu F6.05333 N4 Si2.83333 |
| Title of publication | Structural properties of [Cu(II)3L6] cages: bridged polyatomic anion effects on unprecedented efficiency of heterogeneous catechol oxidation |
| Authors of publication | Kim, Doheon; Gwak, Geonwoo; Han, Jihun; Kim, Dongwon; Jung, Ok-Sang |
| Journal of publication | Dalton Transactions |
| Year of publication | 2022 |
| a | 22.8679 ± 0.0004 Å |
| b | 22.8679 ± 0.0004 Å |
| c | 22.8679 ± 0.0004 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 11958.6 ± 0.4 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173 ± 2 K |
| Number of distinct elements | 7 |
| Space group number | 195 |
| Hermann-Mauguin space group symbol | P 2 3 |
| Hall space group symbol | P 2 2 3 |
| Residual factor for all reflections | 0.136 |
| Residual factor for significantly intense reflections | 0.0778 |
| Weighted residual factors for significantly intense reflections | 0.2069 |
| Weighted residual factors for all reflections included in the refinement | 0.2675 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.094 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 273906 (current) | 2022-03-23 | cif/ Adding structures of 7709804, 7709805, 7709806, 7709807 via cif-deposit CGI script. |
7709807.cif |
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Users of the data should acknowledge the original authors of the
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