Information card for entry 4501634

Structure parameters

• Common name: organotin sulfonate
• Formula: C98 H128 O22 P4 S4 Sn3
• Calculated formula: C98 H116 O22 P4 S4 Sn3
• Title of publication: In Situ Generated Hydrated Diorganotin Cations as Synthons for Hydrogen-Bonded and Coordination-Driven 1D-, 2D-, and 3D-Assemblies
• Authors of publication: Chandrasekhar, Vadapalli; Singh, Puja
• Journal of publication: Crystal Growth & Design
• Year of publication: 2010
• Journal volume: 10
• Journal issue: 7
• Pages of publication: 3077
• a: 11.751 ± 0.005 Å
• b: 11.816 ± 0.005 Å
• c: 18.039 ± 0.005 Å
• α: 88.629 ± 0.005°
• β: 78.684 ± 0.005°
• γ: 89.348 ± 0.005°
• Cell volume: 2455.3 ± 1.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0975
• Residual factor for significantly intense reflections: 0.0696
• Weighted residual factors for significantly intense reflections: 0.1868
• Weighted residual factors for all reflections included in the refinement: 0.2213
• Goodness-of-fit parameter for all reflections included in the refinement: 1.073
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No