Information card for entry 4101632

Structure parameters

• Formula: C62 H135 Mn0.5 Mo9 N5.5 O30
• Calculated formula: C62 H135 Mn0.5 Mo9 N5.5 O30
• Title of publication: Nanoscale chiral rod-like molecular triads assembled from achiral polyoxometalates.
• Authors of publication: Zhang, Jin; Hao, Jian; Wei, Yongge; Xiao, Fengping; Yin, Panchao; Wang, Longsheng
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2010
• Journal volume: 132
• Journal issue: 1
• Pages of publication: 14 - 15
• a: 18.174 ± 0.003 Å
• b: 18.174 ± 0.003 Å
• c: 49.125 ± 0.01 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 14052 ± 4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 152
• Hermann-Mauguin space group symbol: P 31 2 1
• Hall space group symbol: P 31 2"
• Residual factor for all reflections: 0.0845
• Residual factor for significantly intense reflections: 0.0568
• Weighted residual factors for significantly intense reflections: 0.1275
• Weighted residual factors for all reflections included in the refinement: 0.1434
• Goodness-of-fit parameter for all reflections included in the refinement: 1.027
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No