Information card for entry 4075878

Structure parameters

• Formula: C37.5 H20 B Cl F15 P
• Calculated formula: C37.5 H19 B Cl F15 P
• Title of publication: Synthesis and Characterization of the New Alkyl Borates [RB(C6F5)3]-(R = CH2Me, CHMe2, CH2CMe3): Utilization of [Me3CCH2B(C6F5)3]-as a Weakly Coordinating Counteranion during Zirconocene-Induced Catalysis of Propylene Polymerization
• Authors of publication: Bavarian, Neda; Baird, Michael C.
• Journal of publication: Organometallics
• Year of publication: 2005
• Journal volume: 24
• Journal issue: 12
• Pages of publication: 2889
• a: 11.51 ± 0.003 Å
• b: 12.42 ± 0.003 Å
• c: 13.015 ± 0.004 Å
• α: 70.071 ± 0.004°
• β: 87.406 ± 0.004°
• γ: 79.134 ± 0.006°
• Cell volume: 1717.4 ± 0.8 ų
• Cell temperature: 180 ± 2 K
• Ambient diffraction temperature: 180 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.2019
• Residual factor for significantly intense reflections: 0.0657
• Weighted residual factors for significantly intense reflections: 0.1146
• Weighted residual factors for all reflections included in the refinement: 0.1433
• Goodness-of-fit parameter for all reflections included in the refinement: 0.809
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No