Information card for entry 7710809
| Formula |
C48 H88 Fe6 N10 O20 S4 |
| Calculated formula |
C48 H88 Fe6 N10 O20 S4 |
| Title of publication |
A new hexanuclear Fe(III) nanocluster: Synthesis, structure, magnetic properties, and efficient activity as a precatalyst in water oxidation |
| Authors of publication |
Akhtar, Muhammad Nadeem; Bikas, Rahman; AlDamen, Murad A.; Shaghaghi, Zohreh; Shahid, M.; Sokolov, Andrei |
| Journal of publication |
Dalton Transactions |
| Year of publication |
2022 |
| a |
20.5565 ± 0.001 Å |
| b |
13.614 ± 0.0006 Å |
| c |
26.1065 ± 0.0014 Å |
| α |
90° |
| β |
107.997 ± 0.002° |
| γ |
90° |
| Cell volume |
6948.6 ± 0.6 Å3 |
| Cell temperature |
120 ± 2 K |
| Ambient diffraction temperature |
120 ± 2 K |
| Number of distinct elements |
6 |
| 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 |
0.0865 |
| Residual factor for significantly intense reflections |
0.0564 |
| Weighted residual factors for significantly intense reflections |
0.127 |
| Weighted residual factors for all reflections included in the refinement |
0.1399 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.119 |
| Diffraction radiation wavelength |
0.71073 Å |
| Diffraction radiation type |
MoKα |
| Has coordinates |
Yes |
| Has disorder |
Yes |
| Has Fobs |
No |
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