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Information card for entry 7042762
Preview
| Coordinates | 7042762.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C57 H44 Cu F6 N2 O1.25 P3 |
|---|---|
| Calculated formula | C57 H44 Cu F6 N2 O1.25 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 | 22.6154 ± 0.0014 Å |
| b | 20.0116 ± 0.0012 Å |
| c | 21.8373 ± 0.0014 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 9882.9 ± 1.1 Å3 |
| Cell temperature | 123 K |
| Ambient diffraction temperature | 123 K |
| Number of distinct elements | 7 |
| Space group number | 56 |
| Hermann-Mauguin space group symbol | P c c n |
| Hall space group symbol | -P 2ab 2ac |
| Residual factor for all reflections | 0.0713 |
| Residual factor for significantly intense reflections | 0.0605 |
| Weighted residual factors for all reflections | 0.153 |
| Weighted residual factors for significantly intense reflections | 0.1485 |
| Weighted residual factors for all reflections included in the refinement | 0.1528 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.0589 |
| 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. |
7042762.cif |
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