Information card for entry 4067993

Structure parameters

• Chemical name: pentafluoropropenyltriphenyltin
• Formula: C21 H15 F5 Sn
• Calculated formula: C21 H15 F5 Sn
• SMILES: C(=C(\C(F)(F)F)F)(F)\[Sn](c1ccccc1)(c1ccccc1)c1ccccc1
• Title of publication: Pentafluoropropenyl Complexes of Mercury, Germanium, Tin, and Lead Derived from (Z)-CFH═CFCF3and Their Use as Transfer Reagents
• Authors of publication: Brisdon, Alan K.; Pritchard, Robin G.; Thomas, Anthony
• Journal of publication: Organometallics
• Year of publication: 2012
• Journal volume: 31
• Journal issue: 4
• Pages of publication: 1341
• a: 9.6575 ± 0.0003 Å
• b: 11.7113 ± 0.0004 Å
• c: 17.8592 ± 0.0005 Å
• α: 97.498 ± 0.002°
• β: 101.513 ± 0.002°
• γ: 101.856 ± 0.001°
• Cell volume: 1905.82 ± 0.11 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0737
• Residual factor for significantly intense reflections: 0.0612
• Weighted residual factors for significantly intense reflections: 0.1221
• Weighted residual factors for all reflections included in the refinement: 0.1313
• Goodness-of-fit parameter for all reflections included in the refinement: 1.168
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No