Information card for entry 7240125

Structure parameters

• Formula: C76 H112 Ag4 N20 O54 S10 Si W12
• Calculated formula: C76 H112 Ag4 N20 O54 S10 Si W12
• Title of publication: Two Inorganic-Organic Hybrid Silver-Polyoxometalates as Reusable Catalyst for One-Pot Synthesis of Propargylamines via Three-Component Coupling Reaction at Room Temperature
• Authors of publication: Dou, Ming-Yu; Huang, Xianqiang; Yang, Guo-Yu
• Journal of publication: CrystEngComm
• Year of publication: 2020
• a: 14.108 ± 0.0013 Å
• b: 15.0509 ± 0.0014 Å
• c: 16.3421 ± 0.0015 Å
• α: 97.136 ± 0.001°
• β: 108.793 ± 0.002°
• γ: 104.501 ± 0.002°
• Cell volume: 3099.9 ± 0.5 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 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: 0.1372
• Residual factor for significantly intense reflections: 0.0789
• Weighted residual factors for significantly intense reflections: 0.1943
• Weighted residual factors for all reflections included in the refinement: 0.2223
• Goodness-of-fit parameter for all reflections included in the refinement: 0.973
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No