Information card for entry 4109348

Structure parameters

• Formula: C50 H38 B2 F8 Fe3 N10 O
• Calculated formula: C49.68 H41.52 B2 F8 Fe3 N10 O2
• Title of publication: Magnetic Bistability and Single-Crystal-to-Single-Crystal Transformation Induced by Guest Desorption
• Authors of publication: Masayuki Nihei; Lingqin Han; Hiroki Oshio
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2007
• Journal volume: 129
• Pages of publication: 5312 - 5313
• a: 25.04 ± 0.02 Å
• b: 12.792 ± 0.012 Å
• c: 19.806 ± 0.019 Å
• α: 90°
• β: 126.364 ± 0.014°
• γ: 90°
• Cell volume: 5109 ± 8 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 110 ± 2 K
• Number of distinct elements: 7
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.165
• Residual factor for significantly intense reflections: 0.1317
• Weighted residual factors for significantly intense reflections: 0.3394
• Weighted residual factors for all reflections included in the refinement: 0.3631
• Goodness-of-fit parameter for all reflections included in the refinement: 1.033
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No