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Information card for entry 7708564
Preview
| Coordinates | 7708564.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | POB-088b - 17OBA006 |
|---|---|
| Formula | C60 H56 Co4 N4 O20 |
| Calculated formula | C60 H56 Co4 N4 O20 |
| Title of publication | Tailoring the electron density of cobalt oxide clusters to provide highly selective superoxide and peroxide species for aerobic cyclohexane oxidation. |
| Authors of publication | Gutiérrez-Tarriño, Silvia; Gaona-Miguélez, José; Oña-Burgos, Pascual |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2021 |
| a | 17.5793 ± 0.0004 Å |
| b | 19.7177 ± 0.0005 Å |
| c | 21.5413 ± 0.0005 Å |
| α | 70.4554 ± 0.0014° |
| β | 80.3622 ± 0.0014° |
| γ | 70.778 ± 0.0013° |
| Cell volume | 6630.4 ± 0.3 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.1002 |
| Residual factor for significantly intense reflections | 0.0508 |
| Weighted residual factors for significantly intense reflections | 0.1087 |
| Weighted residual factors for all reflections included in the refinement | 0.1307 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.012 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 269959 (current) | 2021-10-15 | cif/ Adding structures of 7708562, 7708563, 7708564 via cif-deposit CGI script. |
7708564.cif |
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Users of the data should acknowledge the original authors of the
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