Information card for entry 4308774

Structure parameters

• Formula: C36 H90 Fe2 N24 Ni3 O12
• Calculated formula: C36 H66 Fe2 N24 Ni3 O12
• Title of publication: A New Bimetallic Intercalated 3-D Assembly Magnet [{(323)Ni}3{FeIII(CN)6}2]n.12nH2O (323 =N,N'-Bis(3-aminopropyl) Ethylenediamine): An Unprecedented Concomitant Presence of Meridional and Facial Arrangment of Ferricyanide Anion
• Authors of publication: Manas K. Saha; María C. Morón; Fernando Palacio; Ivan Bernal
• Journal of publication: Inorganic Chemistry
• Year of publication: 2005
• Journal volume: 44
• Pages of publication: 1354 - 1361
• a: 15.656 ± 0.002 Å
• b: 15.291 ± 0.002 Å
• c: 50.912 ± 0.007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 12188 ± 3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.1422
• Residual factor for significantly intense reflections: 0.0651
• Weighted residual factors for significantly intense reflections: 0.1153
• Weighted residual factors for all reflections included in the refinement: 0.1385
• Goodness-of-fit parameter for all reflections included in the refinement: 1.024
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No