Information card for entry 7217009

Structure parameters

• Common name: [Fe3La(tea)2(dpm)6]
• Formula: C78 H138 Fe3 La N2 O18
• Calculated formula: C78 H138 Fe3 La N2 O18
• Title of publication: Mapping of single-site magnetic anisotropy tensors in weakly coupled spin clusters by torque magnetometry.
• Authors of publication: Rigamonti, Luca; Cornia, Andrea; Nava, Andrea; Perfetti, Mauro; Boulon, Marie-Emmanuelle; Barra, Anne-Laure; Zhong, Xiaoliang; Park, Kyungwha; Sessoli, Roberta
• Journal of publication: Physical chemistry chemical physics : PCCP
• Year of publication: 2014
• Journal volume: 16
• Journal issue: 32
• Pages of publication: 17220 - 17230
• a: 16.821 ± 0.0006 Å
• b: 16.821 ± 0.0006 Å
• c: 55.396 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 13574.2 ± 0.8 ų
• Cell temperature: 140 ± 2 K
• Ambient diffraction temperature: 140 ± 2 K
• Number of distinct elements: 6
• Space group number: 167
• Hermann-Mauguin space group symbol: R -3 c :H
• Hall space group symbol: -R 3 2"c
• Residual factor for all reflections: 0.0477
• Residual factor for significantly intense reflections: 0.0375
• Weighted residual factors for significantly intense reflections: 0.101
• Weighted residual factors for all reflections included in the refinement: 0.1101
• Goodness-of-fit parameter for all reflections included in the refinement: 1.075
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No