Information card for entry 4117300

Structure parameters

• Formula: C45 H46.5 Ag3.5 F7.5 N12 O8.5 S2.5
• Calculated formula: C45 H46.5 Ag3.5 F7.5 N12 O8.5 S2.5
• Title of publication: Stabilization of a Reactive Polynuclear Silver Carbide Cluster through the Encapsulation within a Supramolecular Cage
• Authors of publication: Cai-Yan Gao; Liang Zhao; Mei-Xiang Wang
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2012
• Journal volume: 134
• Pages of publication: 824 - 827
• a: 20.15 ± 0.004 Å
• b: 15.922 ± 0.003 Å
• c: 33.605 ± 0.007 Å
• α: 90°
• β: 90.57 ± 0.03°
• γ: 90°
• Cell volume: 10781 ± 4 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 7
• 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: 0.0645
• Residual factor for significantly intense reflections: 0.0608
• Weighted residual factors for significantly intense reflections: 0.1615
• Weighted residual factors for all reflections included in the refinement: 0.1647
• Goodness-of-fit parameter for all reflections included in the refinement: 1.115
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No