Information card for entry 7128099

Structure parameters

• Formula: C4 H29.5 K3.5 Mn N Na1.5 O34.75 W6
• Calculated formula: C4 H10 K3.5 Mn N Na1.5 O34.75 W6
• Title of publication: Unprecedented monofunctionalized β-Anderson clusters: [R₁R₂C(CH₂O)₂Mn^IVW₆O₂₂]^6-, a class of potential candidates for new inorganic linkers.
• Authors of publication: Li, Qi; Wei, Yongge
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2021
• Journal volume: 57
• Journal issue: 32
• Pages of publication: 3865 - 3868
• a: 16.8017 ± 0.0009 Å
• b: 12.0565 ± 0.0007 Å
• c: 17.3015 ± 0.001 Å
• α: 90°
• β: 98.226 ± 0.005°
• γ: 90°
• Cell volume: 3468.7 ± 0.3 ų
• Cell temperature: 100 ± 0.1 K
• Ambient diffraction temperature: 100 ± 0.1 K
• Number of distinct elements: 8
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/c 1
• Hall space group symbol: -P 2yc
• Residual factor for all reflections: 0.0688
• Residual factor for significantly intense reflections: 0.0508
• Weighted residual factors for significantly intense reflections: 0.1019
• Weighted residual factors for all reflections included in the refinement: 0.1123
• Goodness-of-fit parameter for all reflections included in the refinement: 1.066
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No