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Information card for entry 7702891
Preview
| Coordinates | 7702891.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Chemical name | data_Rubim_OH2_2 |
|---|---|
| Formula | C21 H19 B2 F8 N7 O Ru |
| Calculated formula | C21 H19 B2 F8 N7 O Ru |
| Title of publication | A mononuclear ruthenium complex showing multiple proton-coupled electron transfer toward multi-electron transfer reactions. |
| Authors of publication | Okamura, Masaya; Yoshida, Masaki; Kuga, Reiko; Sakai, Ken; Kondo, Mio; Masaoka, Shigeyuki |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2012 |
| Journal volume | 41 |
| Journal issue | 42 |
| Pages of publication | 13081 - 13089 |
| a | 10.0573 ± 0.0038 Å |
| b | 15.8424 ± 0.006 Å |
| c | 16.3412 ± 0.0066 Å |
| α | 90° |
| β | 105.971 ± 0.0051° |
| γ | 90° |
| Cell volume | 2503.2 ± 1.7 Å3 |
| Cell temperature | 153 ± 2 K |
| Ambient diffraction temperature | 153 ± 2 K |
| Number of distinct elements | 7 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/a 1 |
| Hall space group symbol | -P 2yab |
| Residual factor for all reflections | 0.0689 |
| Residual factor for significantly intense reflections | 0.0609 |
| Weighted residual factors for significantly intense reflections | 0.1484 |
| Weighted residual factors for all reflections included in the refinement | 0.154 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.154 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301878 (current) | 2025-08-23 | Add cross-references to PubChem compounds in COD range 7/70/ Each referenced PubChem compound corresponds to the full crystal structure. |
7702891.cif |
| 244220 | 2019-11-28 | cif/ Adding structures of 7702890, 7702891 via cif-deposit CGI script. |
7702891.cif |
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Users of the data should acknowledge the original authors of the
structural data.