Information card for entry 7104770

Structure parameters

• Formula: C32 H78 Al Mn2 Mo6 N4 Na O50
• Calculated formula: C32 H66 Al Mn2 Mo6 N4 Na O50
• Title of publication: Polyoxometalate-based {Mn(III)2}-Schiff base composite materials exhibiting single-molecule magnet behaviour.
• Authors of publication: Wu, Qiong; Li, Yang-Guang; Wang, Yong-Hui; Clérac, Rodolphe; Lu, Ying; Wang, En-Bo
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2009
• Journal volume: 34
• Journal issue: 38
• Pages of publication: 5743 - 5745
• a: 10.86 ± 0.002 Å
• b: 11.219 ± 0.002 Å
• c: 15.377 ± 0.003 Å
• α: 105.62 ± 0.03°
• β: 98.15 ± 0.03°
• γ: 109.04 ± 0.03°
• Cell volume: 1650.4 ± 0.6 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0719
• Residual factor for significantly intense reflections: 0.047
• Weighted residual factors for significantly intense reflections: 0.0975
• Weighted residual factors for all reflections included in the refinement: 0.1086
• Goodness-of-fit parameter for all reflections included in the refinement: 1.049
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No