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Information card for entry 7711857
Preview
| Coordinates | 7711857.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C126.8 H240.11 Cr11.27 F15.27 N4 O46.26 Zn1.74 |
|---|---|
| Calculated formula | C126.796 H240.098 Cr11.283 F15.283 N4 O46.253 Zn1.718 |
| Title of publication | Templating metallocycles with a macrocycle: synthesis, structures and magnetic studies of {Cr<sub>11</sub>M<sub>2</sub>} complexes. |
| Authors of publication | Alotaibi, Rajeh; Brookfield, Adam; Fowler, Jonathan M.; Whitehead, George F. S.; Lockyer, Selena J.; Timco, Grigore A.; Collison, David; Schnack, Jürgen; Winpenny, Richard E. P. |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2022 |
| Journal volume | 52 |
| Journal issue | 1 |
| Pages of publication | 20 - 23 |
| a | 20.266 ± 0.0006 Å |
| b | 21.0542 ± 0.0006 Å |
| c | 24.7966 ± 0.0006 Å |
| α | 82.82 ± 0.002° |
| β | 77.658 ± 0.002° |
| γ | 62.886 ± 0.003° |
| Cell volume | 9195.3 ± 0.5 Å3 |
| Cell temperature | 150.06 ± 0.14 K |
| Ambient diffraction temperature | 150.06 ± 0.14 K |
| Number of distinct elements | 7 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0921 |
| Residual factor for significantly intense reflections | 0.0678 |
| Weighted residual factors for significantly intense reflections | 0.1948 |
| Weighted residual factors for all reflections included in the refinement | 0.2153 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.014 |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 283231 (current) | 2023-05-05 | cif/ Updating files of 7711856, 7711857 Original log message: Adding full bibliography for 7711856--7711857.cif. |
7711857.cif |
| 279659 | 2022-12-01 | cif/ Adding structures of 7711856, 7711857 via cif-deposit CGI script. |
7711857.cif |
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Users of the data should acknowledge the original authors of the
structural data.