Information card for entry 4111872

Structure parameters

• Formula: C109 H112 Cl3 O27 Sn6
• Calculated formula: C109 H109 Cl3 O27 Sn6
• Title of publication: Alternating Hydrophilic and Hydrophobic Pockets in the Channel Structures of Organostannoxane Prismanes: Preferential Confinement of Guest Molecules
• Authors of publication: Vadapalli Chandrasekhar; Pakkirisamy Thilagar; James F. Bickley; Alexander Steiner
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2005
• Journal volume: 127
• Pages of publication: 11556 - 11557
• a: 16.387 ± 0.003 Å
• b: 17.701 ± 0.003 Å
• c: 22.903 ± 0.004 Å
• α: 86.44 ± 0.02°
• β: 88.2 ± 0.02°
• γ: 64.628 ± 0.017°
• Cell volume: 5991 ± 2 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0897
• Residual factor for significantly intense reflections: 0.0487
• Weighted residual factors for significantly intense reflections: 0.1197
• Weighted residual factors for all reflections included in the refinement: 0.1314
• Goodness-of-fit parameter for all reflections included in the refinement: 0.865
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No