Information card for entry 7046601

Structure parameters

• Formula: C18 H59 La2 N3 O66.5 P W11
• Calculated formula: C18 H29 La2 N3 O52 P W11
• Title of publication: Hybrid dimers based on metal-substituted Keggin polyoxometalates (metal = Ti, Ln) for cyanosilylation catalysis.
• Authors of publication: An, Haiyan; Zhang, Yumeng; Hou, Yujiao; Hu, Tao; Yang, Wei; Chang, Shenzhen; Zhang, Jianjun
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2018
• Journal volume: 47
• Journal issue: 27
• Pages of publication: 9079 - 9089
• a: 13.0114 ± 0.0005 Å
• b: 14.3598 ± 0.0006 Å
• c: 21.4373 ± 0.0008 Å
• α: 96.428 ± 0.002°
• β: 91.62 ± 0.002°
• γ: 95.623 ± 0.002°
• Cell volume: 3957.9 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0715
• Residual factor for significantly intense reflections: 0.055
• Weighted residual factors for significantly intense reflections: 0.1414
• Weighted residual factors for all reflections included in the refinement: 0.1497
• Goodness-of-fit parameter for all reflections included in the refinement: 1.057
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No