Information card for entry 4083163

Structure parameters

• Formula: C36 H28 F P Sn
• Calculated formula: C36 H28 F P Sn
• SMILES: [Sn]1([P](c2ccc3CCc4ccc1c2c34)(c1ccccc1)c1ccccc1)(F)(c1ccccc1)c1ccccc1
• Title of publication: Intramolecularly Coordinated (6-(Diphenylphosphino)acenaphth-5-yl)stannanes. Repulsion vs Attraction of P- and Sn-Containing Substituents in theperiPositions
• Authors of publication: Hupf, Emanuel; Lork, Enno; Mebs, Stefan; Beckmann, Jens
• Journal of publication: Organometallics
• Year of publication: 2014
• Journal volume: 33
• Journal issue: 10
• Pages of publication: 2409
• a: 10.904 ± 0.002 Å
• b: 18.628 ± 0.004 Å
• c: 28.006 ± 0.006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5689 ± 2 ų
• Cell temperature: 173 K
• Ambient diffraction temperature: 173 K
• Number of distinct elements: 5
• Space group number: 61
• Hermann-Mauguin space group symbol: P c a b
• Hall space group symbol: -P 2bc 2ac
• Residual factor for all reflections: 0.1632
• Residual factor for significantly intense reflections: 0.0762
• Weighted residual factors for significantly intense reflections: 0.1182
• Weighted residual factors for all reflections included in the refinement: 0.1511
• Goodness-of-fit parameter for all reflections included in the refinement: 0.89
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No