Information card for entry 7032186

Structure parameters

• Formula: C72 H48 Ag6 Cl2 N24 O42 Si W12
• Calculated formula: C72 H48 Ag6 Cl2 N24 O42 Si W12
• Title of publication: pH-dependent assembly of two polyoxometalate host-guest structural isomers based on Keggin polyoxoanion templates.
• Authors of publication: Zhang, Lei; Yang, Wenbin; Kuang, Xiaofei; Wu, Xiaoyuan; Lu, Canzhong
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2014
• Journal volume: 43
• Journal issue: 43
• Pages of publication: 16328 - 16334
• a: 22.6655 ± 0.0005 Å
• b: 18.8656 ± 0.0003 Å
• c: 24.6036 ± 0.0005 Å
• α: 90°
• β: 107.228 ± 0.002°
• γ: 90°
• Cell volume: 10048.4 ± 0.4 ų
• Cell temperature: 100 ± 0.15 K
• Ambient diffraction temperature: 100 ± 0.15 K
• Number of distinct elements: 8
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0492
• Residual factor for significantly intense reflections: 0.0417
• Weighted residual factors for significantly intense reflections: 0.0992
• Weighted residual factors for all reflections included in the refinement: 0.1053
• Goodness-of-fit parameter for all reflections included in the refinement: 1.096
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No