Information card for entry 4071506

Structure parameters

• Formula: C20 H24 F6 N2 O6 S2 Sn
• Calculated formula: C20 H24 F6 N2 O6 S2 Sn
• SMILES: [Sn]12(c3c(cccc3C[N]2(C)C)C[N]1(C)C)(c1ccccc1)(OS(=O)(=O)C(F)(F)F)OS(=O)(=O)C(F)(F)F
• Title of publication: Role of Y,C,Y-Chelating Ligands in Control Hydrolysis of Diorganotin Compounds†
• Authors of publication: Kašná, Blanka; Dostál, Libor; Jirásko, Robert; Císařová, Ivana; Jambor, Roman
• Journal of publication: Organometallics
• Year of publication: 2008
• Journal volume: 27
• Journal issue: 15
• Pages of publication: 3743
• a: 13.7458 ± 0.0003 Å
• b: 9.3395 ± 0.0001 Å
• c: 19.9533 ± 0.0004 Å
• α: 90°
• β: 98.0965 ± 0.0009°
• γ: 90°
• Cell volume: 2536.05 ± 0.08 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 7
• 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: 0.0263
• Residual factor for significantly intense reflections: 0.0243
• Weighted residual factors for significantly intense reflections: 0.0566
• Weighted residual factors for all reflections included in the refinement: 0.0575
• Goodness-of-fit parameter for all reflections included in the refinement: 1.075
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No