Information card for entry 4129929

Structure parameters

• Formula: C84 H60 Co6 Fe3 N48 O36 W6
• Calculated formula: C84 H60 Co6 Fe3 N48 O36 W6
• Title of publication: Tuning of Charge Transfer Assisted Phase Transition and Slow Magnetic Relaxation Functionalities in {Fe(9-x)Co(x)[W(CN)8]6} (x = 0-9) Molecular Solid Solution.
• Authors of publication: Chorazy, Szymon; Stanek, Jan J.; Nogaś, Wojciech; Majcher, Anna M.; Rams, Michał; Kozieł, Marcin; Juszyńska-Gałązka, Ewa; Nakabayashi, Koji; Ohkoshi, Shin-ichi; Sieklucka, Barbara; Podgajny, Robert
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2016
• Journal volume: 138
• Journal issue: 5
• Pages of publication: 1635 - 1646
• a: 28.9608 ± 0.0006 Å
• b: 19.3329 ± 0.0005 Å
• c: 32.6113 ± 0.0006 Å
• α: 90°
• β: 114.018 ± 0.001°
• γ: 90°
• Cell volume: 16678 ± 0.6 ų
• Cell temperature: 250 ± 2 K
• Ambient diffraction temperature: 250 ± 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: 0.0778
• Residual factor for significantly intense reflections: 0.0587
• Weighted residual factors for significantly intense reflections: 0.1686
• Weighted residual factors for all reflections included in the refinement: 0.2267
• Goodness-of-fit parameter for all reflections included in the refinement: 1.18
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No