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Information card for entry 7711704
Preview
| Coordinates | 7711704.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C102 H134 B3 Cr F12 N14 |
|---|---|
| Calculated formula | C102 H134 B3 Cr F12 N14 |
| Title of publication | Bulky ligands protect molecular ruby from oxygen quenching |
| Authors of publication | Stein, Laura; Wang, Cui; Förster, Christoph; Resch-Genger, Ute; Heinze, Katja |
| Journal of publication | Dalton Transactions |
| Year of publication | 2022 |
| a | 20.8456 ± 0.0002 Å |
| b | 34.2952 ± 0.0004 Å |
| c | 28.337 ± 0.0003 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 20258.2 ± 0.4 Å3 |
| Cell temperature | 120 ± 2 K |
| Ambient diffraction temperature | 120 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 61 |
| Hermann-Mauguin space group symbol | P b c a |
| Hall space group symbol | -P 2ac 2ab |
| Residual factor for all reflections | 0.0743 |
| Residual factor for significantly intense reflections | 0.0565 |
| Weighted residual factors for significantly intense reflections | 0.1461 |
| Weighted residual factors for all reflections included in the refinement | 0.1515 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.934 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 279049 (current) | 2022-11-08 | cif/ Adding structures of 7711704, 7711705, 7711706 via cif-deposit CGI script. |
7711704.cif |
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