Information card for entry 4345689

Structure parameters

• Formula: C36 H20 Cl2 F8 P2 Sn
• Calculated formula: C36 H20 Cl2 F8 P2 Sn
• SMILES: c1(c(c(c(c(c1F)F)F)F)P(c1ccccc1)c1ccccc1)[Sn](Cl)(c1c(c(c(c(c1F)F)F)F)P(c1ccccc1)c1ccccc1)Cl
• Title of publication: Tin(IV) Compounds with 2-C6F4PPh2 Substituents and Their Reactivity toward Palladium(0): Formation of Tin‒Palladium Complexes via Oxidative Addition
• Authors of publication: Wächtler, Erik; Wahlicht, Sven; Privér, Steven H.; Bennett, Martin A.; Gerke, Birgit; Pöttgen, Rainer; Brendler, Erica; Gericke, Robert; Wagler, Jörg; Bhargava, Suresh K.
• Journal of publication: Inorganic Chemistry
• Year of publication: 2017
• a: 16.3329 ± 0.0008 Å
• b: 11.761 ± 0.0005 Å
• c: 18.1754 ± 0.0009 Å
• α: 90°
• β: 102.961 ± 0.001°
• γ: 90°
• Cell volume: 3402.4 ± 0.3 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0377
• Residual factor for significantly intense reflections: 0.0338
• Weighted residual factors for significantly intense reflections: 0.07
• Weighted residual factors for all reflections included in the refinement: 0.0713
• Goodness-of-fit parameter for all reflections included in the refinement: 1.114
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No