Information card for entry 4305290

Structure parameters

• Formula: C17 H31 O6 P S Sn
• Calculated formula: C17 H31 O6 P S Sn
• Title of publication: Synthesis, Characterization, and Structural Studies of Mixed-Ligand Diorganotin Esters, [R2Sn(OP(O)(OH)Ph)(OS(O)2R1)]n [R =n-Bu, R1= Me (1), n-Pr (2); R = Et, R1= Me (3)] with 1D and 3D Coordination Polymeric Motifs
• Authors of publication: Ravi Shankar; Atul Pratap Singh; Archana Jain; Mary F. Mahon; Kieran C. Molloy
• Journal of publication: Inorganic Chemistry
• Year of publication: 2008
• Journal volume: 47
• Pages of publication: 5930 - 5935
• a: 9.8494 ± 0.0002 Å
• b: 14.04 ± 0.0003 Å
• c: 16.3432 ± 0.0004 Å
• α: 90°
• β: 97.338 ± 0.001°
• γ: 90°
• Cell volume: 2241.52 ± 0.09 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0509
• Residual factor for significantly intense reflections: 0.0344
• Weighted residual factors for significantly intense reflections: 0.0744
• Weighted residual factors for all reflections included in the refinement: 0.0811
• Goodness-of-fit parameter for all reflections included in the refinement: 1.094
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No