Information card for entry 4501629

Structure parameters

• Common name: organotin sulfonate
• Formula: C28 H32 N2 O8 S2 Sn
• Calculated formula: C28 H14 N2 O8 S2 Sn
• 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: 7.9839 ± 0.0009 Å
• b: 9.9867 ± 0.0012 Å
• c: 10.9059 ± 0.0013 Å
• α: 106.101 ± 0.002°
• β: 106.472 ± 0.002°
• γ: 106.237 ± 0.002°
• Cell volume: 738.12 ± 0.15 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: 0.047
• Residual factor for significantly intense reflections: 0.0435
• Weighted residual factors for significantly intense reflections: 0.1234
• Weighted residual factors for all reflections included in the refinement: 0.1387
• Goodness-of-fit parameter for all reflections included in the refinement: 1.157
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No