Information card for entry 4501633

Structure parameters

• Common name: organotin sulfonate
• Formula: C54 H60 N4 O16 S4 Sn
• Calculated formula: C54 H60 N4 O16 S4 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: 22.376 ± 0.002 Å
• b: 7.6045 ± 0.0008 Å
• c: 30.762 ± 0.003 Å
• α: 90°
• β: 91.763 ± 0.002°
• γ: 90°
• Cell volume: 5231.9 ± 0.9 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0589
• Residual factor for significantly intense reflections: 0.0441
• Weighted residual factors for significantly intense reflections: 0.1112
• Weighted residual factors for all reflections included in the refinement: 0.1229
• Goodness-of-fit parameter for all reflections included in the refinement: 1.07
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No