Information card for entry 7014555

Structure parameters

• Formula: C58 H102 B2 Co2 Cu2 Fe2 N18 O24 P6
• Calculated formula: C58 H102 B2 Co2 Cu2 Fe2 N18 O24 P6
• Title of publication: Hexanuclear Fe(III)(2)Co(III)(2)M(II)(2) (M = Cu, Ni, Mn) clusters based on Kläui's tripodal ligand and tricyanometalates: syntheses, structures and magnetic properties.
• Authors of publication: Kang, Ling-Chen; Yao, Min-Xia; Chen, Xin; Li, Yi-Zhi; Song, You; Zuo, Jing-Lin; You, Xiao-Zeng
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2011
• Journal volume: 40
• Journal issue: 10
• Pages of publication: 2204 - 2212
• a: 11.4121 ± 0.0019 Å
• b: 13.054 ± 0.002 Å
• c: 17.391 ± 0.003 Å
• α: 103.191 ± 0.003°
• β: 103.093 ± 0.003°
• γ: 108.014 ± 0.003°
• Cell volume: 2271.9 ± 0.7 ų
• Cell temperature: 291 ± 2 K
• Ambient diffraction temperature: 291 ± 2 K
• Number of distinct elements: 9
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0687
• Residual factor for significantly intense reflections: 0.0557
• Weighted residual factors for significantly intense reflections: 0.1651
• Weighted residual factors for all reflections included in the refinement: 0.1737
• Goodness-of-fit parameter for all reflections included in the refinement: 1.086
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No