Information card for entry 2014141

Structure parameters

• Chemical name: Bis(η^5^-cyclopentadienyl)[rel-(1R,5S,7R,14S)-(1,3,5,7,9,11,14- heptacyclopentyl-7,14-dihydroxytricyclo[7.3.3.0^15,11^]heptasiloxan-3- yl)bis(pentafluorophenyl)borinato(2-)]zirconium
• Formula: C57 H73 B F10 O12 Si7 Zr
• Calculated formula: C57 H73 B F10 O12 Si7 Zr
• Title of publication: A fluorophenylboron-functionalized zirconium silsesquioxane complex
• Authors of publication: Garrison, Jered C.; Kim, Hoon; Collins, Scott; Youngs, Wiley J.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2004
• Journal volume: 60
• Journal issue: 7
• Pages of publication: m357 - m359
• a: 11.0484 ± 0.0017 Å
• b: 11.3415 ± 0.0018 Å
• c: 25.919 ± 0.004 Å
• α: 82.62 ± 0.003°
• β: 86.414 ± 0.003°
• γ: 82.697 ± 0.003°
• Cell volume: 3191.2 ± 0.9 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1154
• Residual factor for significantly intense reflections: 0.0686
• Weighted residual factors for significantly intense reflections: 0.1382
• Weighted residual factors for all reflections included in the refinement: 0.16
• Goodness-of-fit parameter for all reflections included in the refinement: 0.927
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes