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Information card for entry 7042763
Preview
| Coordinates | 7042763.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C59 H48 Cu F6 N2 O2 P3 |
|---|---|
| Calculated formula | C59 H48 Cu F6 N2 O2 P3 |
| Title of publication | The effects of introducing sterically demanding aryl substituents in [Cu(N^N)(P^P)]+ complexes |
| Authors of publication | Housecroft, Catherine E.; Constable, Edwin C.; Brunner, Fabian; Häussinger, Daniel; Graber, Stefan; Prescimone, Alessandro; Baumgartner, Yann |
| Journal of publication | Dalton Trans. |
| Year of publication | 2017 |
| a | 22.2781 ± 0.0011 Å |
| b | 14.7143 ± 0.0008 Å |
| c | 15.4481 ± 0.0007 Å |
| α | 90° |
| β | 99.249 ± 0.003° |
| γ | 90° |
| Cell volume | 4998.2 ± 0.4 Å3 |
| Cell temperature | 123 K |
| Ambient diffraction temperature | 123 K |
| Number of distinct elements | 7 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.0572 |
| Residual factor for significantly intense reflections | 0.0432 |
| Weighted residual factors for all reflections | 0.1067 |
| Weighted residual factors for significantly intense reflections | 0.0866 |
| Weighted residual factors for all reflections included in the refinement | 0.1067 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.8433 |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 195738 (current) | 2017-04-25 | cif/ Adding structures of 7042761, 7042762, 7042763, 7042764, 7042765 via cif-deposit CGI script. |
7042763.cif |
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