Information card for entry 4075539

Structure parameters

• Formula: C24 H40 F12 O2 P2 Sn
• Calculated formula: C24 H40 F12 O2 P2 Sn
• SMILES: [Sn]12([P](CC(O1)(C(F)(F)F)C(F)(F)F)(C(C)(C)C)C(C)(C)C)[P](CC(O2)(C(F)(F)F)C(F)(F)F)(C(C)(C)C)C(C)(C)C
• Title of publication: Divalent Germanium and Tin Compounds Stabilized by Sterically Bulky P∧O, PO∧O, PS∧O, and PN∧O Ligands: Synthesis and First Insights into Catalytic Application to Polyurethane Systems†
• Authors of publication: Ionkin, Alex S.; Marshall, William J.; Fish, Brian M.
• Journal of publication: Organometallics
• Year of publication: 2006
• Journal volume: 25
• Journal issue: 17
• Pages of publication: 4170
• a: 10.976 ± 0.004 Å
• b: 16.162 ± 0.004 Å
• c: 19.627 ± 0.004 Å
• α: 71.845 ± 0.008°
• β: 89.785 ± 0.008°
• γ: 77.397 ± 0.008°
• Cell volume: 3220.9 ± 1.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0649
• Residual factor for significantly intense reflections: 0.0522
• Weighted residual factors for significantly intense reflections: 0.1425
• Weighted residual factors for all reflections included in the refinement: 0.151
• Goodness-of-fit parameter for all reflections included in the refinement: 1.051
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No