Information card for entry 4302425

Structure parameters

• Common name: Nd(DMF)6Fe(CN)6
• Chemical name: hexakis(N,N-dimethylformamide)Neodymium(III) hexacyanoferrate(III)
• Formula: C24 H42 Fe N12 Nd O6
• Calculated formula: C24 H42 Fe N12 Nd O6
• Title of publication: Water-Free Rare Earth-Prussian Blue Type Analogues: Synthesis, Structure, Computational Analysis, and Magnetic Data of {LnIII(DMF)6FeIII(CN)6}∞(Ln = Rare Earths Excluding Pm)
• Authors of publication: Duane C. Wilson; Shengming Liu; Xuenian Chen; Edward A. Meyers; Xiaoguang Bao; Andrey V. Prosvirin; Kim R. Dunbar; Christopher M. Hadad; Sheldon G. Shore
• Journal of publication: Inorganic Chemistry
• Year of publication: 2009
• Journal volume: 48
• Pages of publication: 5725 - 5735
• a: 19.349 ± 0.004 Å
• b: 9.862 ± 0.002 Å
• c: 19.41 ± 0.004 Å
• α: 90°
• β: 113.38 ± 0.03°
• γ: 90°
• Cell volume: 3399.7 ± 1.4 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/n 1
• Hall space group symbol: -P 2yac
• Residual factor for all reflections: 0.0566
• Residual factor for significantly intense reflections: 0.0307
• Weighted residual factors for significantly intense reflections: 0.059
• Weighted residual factors for all reflections included in the refinement: 0.0652
• Goodness-of-fit parameter for all reflections included in the refinement: 1.043
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No