Information card for entry 4120672

Structure parameters

• Formula: C162 H206 Ag2 F30 Ir8 N18 O66 S10 Zn4
• Calculated formula: C162 H158 Ag2 F30 Ir8 N18 O66 S10 Zn4
• Title of publication: Stepwise Construction of Discrete Heterometallic Coordination Cages Based on Self-Sorting Strategy.
• Authors of publication: Li, Hao; Han, Ying-Feng; Lin, Yue-Jian; Guo, Zi-Wei; Jin, Guo-Xin
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2014
• Journal volume: 136
• Journal issue: 8
• Pages of publication: 2982
• a: 15.892 ± 0.004 Å
• b: 32.88 ± 0.008 Å
• c: 20.486 ± 0.005 Å
• α: 90°
• β: 94.06 ± 0.005°
• γ: 90°
• Cell volume: 10678 ± 5 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 9
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.113
• Residual factor for significantly intense reflections: 0.0605
• Weighted residual factors for significantly intense reflections: 0.1517
• Weighted residual factors for all reflections included in the refinement: 0.1779
• Goodness-of-fit parameter for all reflections included in the refinement: 1.007
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No