Information card for entry 7714760

Structure parameters

• Formula: C27 H23 Co F12 Fe N2 O6
• Calculated formula: C27 H23 Co F12 Fe N2 O6
• Title of publication: Ferrocenyl-substituted nitronyl nitroxide in the design of one-dimensional magnets.
• Authors of publication: Maryunina, Kseniya; Nigomedyanova, Daria; Morozov, Vitaly; Smirnova, Kristina; Letyagin, Gleb; Romanenko, Galina; Efimov, Nikolay; Bogomyakov, Artem; Ovcharenko, Victor
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2024
• Journal volume: 53
• Journal issue: 4
• Pages of publication: 1714 - 1721
• a: 14.2966 ± 0.0011 Å
• b: 15.5154 ± 0.0013 Å
• c: 14.4767 ± 0.0012 Å
• α: 90°
• β: 96.601 ± 0.005°
• γ: 90°
• Cell volume: 3189.9 ± 0.5 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.146
• Residual factor for significantly intense reflections: 0.0542
• Weighted residual factors for significantly intense reflections: 0.0931
• Weighted residual factors for all reflections included in the refinement: 0.1179
• Goodness-of-fit parameter for all reflections included in the refinement: 1.021
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No