Information card for entry 4301591

Structure parameters

• Formula: C56 H84 N22 Ni3 O6
• Calculated formula: C56 H84 N22 Ni3 O6
• Title of publication: Ferromagnetic Superexchange Coupling through a Diamagnetic Iron(II) Ion in a Mixed-Valent Iron(III, II, III) meso-Helicate
• Authors of publication: Toshihide Mochizuki; Takashi Nogami; Takayuki Ishida
• Journal of publication: Inorganic Chemistry
• Year of publication: 2009
• Journal volume: 48
• Pages of publication: 2254 - 2259
• a: 9.709 ± 0.002 Å
• b: 13.109 ± 0.004 Å
• c: 13.984 ± 0.004 Å
• α: 101.136 ± 0.005°
• β: 94.915 ± 0.008°
• γ: 98.563 ± 0.01°
• Cell volume: 1714.8 ± 0.8 ų
• Cell temperature: 296 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for significantly intense reflections: 0.0579
• Weighted residual factors for all reflections included in the refinement: 0.0892
• Goodness-of-fit parameter for all reflections included in the refinement: 1.348
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No