Information card for entry 7701425
| Formula |
C85 H74.33 Fe2 O21.25 |
| Calculated formula |
C85 H74.3333 Fe2 O21.25 |
| Title of publication |
Designed Asymmetric Coordination Helicates with bis-β-diketonate Ligands |
| Authors of publication |
Aromi, Guillem; Darawsheh, Mohanad; Diego, Rosa; Barrios, Leoní Alejandra; Sadurní, Anna; Garcia Gomez, Jordi; Lloyd, Paul; Teat, Simon; Roubeau, Olivier; Aguilà, David |
| Journal of publication |
Dalton Transactions |
| Year of publication |
2019 |
| a |
23.4757 ± 0.0017 Å |
| b |
34.645 ± 0.002 Å |
| c |
30.737 ± 0.002 Å |
| α |
90° |
| β |
105.815 ± 0.002° |
| γ |
90° |
| Cell volume |
24053 ± 3 Å3 |
| Cell temperature |
193 ± 2 K |
| Ambient diffraction temperature |
193 ± 2 K |
| Number of distinct elements |
4 |
| Space group number |
14 |
| Hermann-Mauguin space group symbol |
P 1 21/n 1 |
| Hall space group symbol |
-P 2yn |
| Residual factor for all reflections |
0.0831 |
| Residual factor for significantly intense reflections |
0.0681 |
| Weighted residual factors for significantly intense reflections |
0.2119 |
| Weighted residual factors for all reflections included in the refinement |
0.2269 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.014 |
| Diffraction radiation wavelength |
0.7749 Å |
| Diffraction radiation type |
synchrotron |
| Has coordinates |
Yes |
| Has disorder |
Yes |
| Has Fobs |
No |
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https://www.crystallography.net/7701425.html
