Information card for entry 7009581

Structure parameters

• Common name: Etheidi Chloride Crust
• Formula: C80 H255 Cl Fe19 N10 O130.5
• Calculated formula: C80 H134 Cl Fe19 N10 O130.5
• Title of publication: Towards nanostructured arrays of single molecule magnets: new Fe19 oxyhydroxide clusters displaying high ground state spins and hysteresis †
• Authors of publication: Goodwin, Jeremy C.; Sessoli, Roberta; Gatteschi, Dante; Wernsdorfer, Wolfgang; Powell, Annie K.; Heath, Sarah L.
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 2000
• Journal issue: 12
• Pages of publication: 1835
• a: 13.4249 ± 0.0014 Å
• b: 18.7748 ± 0.0019 Å
• c: 20.099 ± 0.002 Å
• α: 117.717 ± 0.002°
• β: 91.271 ± 0.002°
• γ: 91.711 ± 0.002°
• Cell volume: 4478.9 ± 0.8 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1502
• Residual factor for significantly intense reflections: 0.0668
• Weighted residual factors for significantly intense reflections: 0.1577
• Weighted residual factors for all reflections included in the refinement: 0.186
• Goodness-of-fit parameter for all reflections included in the refinement: 0.881
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No