Information card for entry 4323106

Structure parameters

• Formula: C68 H74 Cu2 Mn2 N8 O18
• Calculated formula: C140 H96 Cu4 Mn4 N16 O40
• Title of publication: Synthesis, Magnetic Properties, and Incomplete Double-Cubane Structure of Manganese(III)-Metal(II) Complexes [Mn(MeOH)L(OH)M(bpy)]2 (M = Zn, Cu, Ni, and Mn; H4L = 1,2-Bis(2-hydroxybenzamido)benzene; bpy = 2,2'-Bipyridine)
• Authors of publication: Yukinari Sunatsuki; Hiromitsu Shimada; Toshihiro Matsuo; Masaaki Nakamura; Fumiaki Kai; Naohide Matsumoto; Nazzareno Re
• Journal of publication: Inorganic Chemistry
• Year of publication: 1998
• Journal volume: 37
• Pages of publication: 5566 - 5574
• a: 13.447 ± 0.001 Å
• b: 12.67 ± 0.002 Å
• c: 21.732 ± 0.001 Å
• α: 90°
• β: 107.076 ± 0.005°
• γ: 90°
• Cell volume: 3539.3 ± 0.6 ų
• Cell temperature: 20 K
• Ambient diffraction temperature: 20 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for significantly intense reflections: 0.059
• Weighted residual factors for significantly intense reflections: 0.049
• Goodness-of-fit parameter for significantly intense reflections: 2.99
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKalpha
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No