Information card for entry 7013056

Structure parameters

• Formula: C46 H52 F6 O10 P2 S2 Sn
• Calculated formula: C46 H52 F6 O10 P2 S2 Sn
• Title of publication: Diorganotin dications stabilized by neutral ligands in the solid state: [R2Sn(H2O)2(OPPh3)2](O3SCF3)2 (R = Me, Bu)
• Authors of publication: Beckmann, Jens; Dakternieks, Dainis; Duthie, Andrew; Mitchell, Cassandra
• Journal of publication: Dalton Transactions
• Year of publication: 2003
• Journal issue: 16
• Pages of publication: 3258
• a: 12.126 ± 0.003 Å
• b: 20.297 ± 0.004 Å
• c: 10.295 ± 0.002 Å
• α: 90°
• β: 93.037 ± 0.004°
• γ: 90°
• Cell volume: 2530.3 ± 0.9 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0504
• Residual factor for significantly intense reflections: 0.0403
• Weighted residual factors for significantly intense reflections: 0.1006
• Weighted residual factors for all reflections included in the refinement: 0.1063
• Goodness-of-fit parameter for all reflections included in the refinement: 1.043
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No