Information card for entry 7003167

Structure parameters

• Common name: Tetrafluoro(3,6-dithiaoctane-S,S')tin(IV)
• Chemical name: Tetrafluoro(3,6-dithiaoctane-S,S')tin(IV)
• Formula: C6 H14 F4 S2 Sn
• Calculated formula: C6 H14 F4 S2 Sn
• SMILES: [Sn]1(F)(F)(F)(F)[S](CC)CC[S]1CC
• Title of publication: The first examples of germanium tetrafluoride and tin tetrafluoride complexes with soft thioether coordination—synthesis, properties and crystal structures
• Authors of publication: Davis, Martin F.; Levason, William; Reid, Gillian; Webster, Michael; Zhang, Wenjian
• Journal of publication: Dalton Transactions
• Year of publication: 2008
• Journal issue: 4
• Pages of publication: 533 - 538
• a: 11.093 ± 0.002 Å
• b: 8.4148 ± 0.0015 Å
• c: 12.276 ± 0.002 Å
• α: 90°
• β: 100.627 ± 0.007°
• γ: 90°
• Cell volume: 1126.3 ± 0.3 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 5
• 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: 0.0204
• Residual factor for significantly intense reflections: 0.0177
• Weighted residual factors for significantly intense reflections: 0.0363
• Weighted residual factors for all reflections included in the refinement: 0.0377
• Goodness-of-fit parameter for all reflections included in the refinement: 1.066
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No