Information card for entry 4501632

Structure parameters

• Common name: organotin sulfonate
• Formula: C44 H62 N4 O15 S2 Sn
• Calculated formula: C44 H52 N4 O15 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: 22.765 ± 0.005 Å
• b: 13.306 ± 0.005 Å
• c: 17.78 ± 0.005 Å
• α: 90 ± 0.005°
• β: 111.187 ± 0.005°
• γ: 90 ± 0.005°
• Cell volume: 5022 ± 3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• 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: 0.0932
• Residual factor for significantly intense reflections: 0.0532
• Weighted residual factors for significantly intense reflections: 0.1239
• Weighted residual factors for all reflections included in the refinement: 0.1623
• Goodness-of-fit parameter for all reflections included in the refinement: 1.054
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No