Information card for entry 7703465

Structure parameters

• Formula: C48 H70 Si2 Zr
• Calculated formula: C48 H70 Si2 Zr
• Title of publication: 2,5-Bis-trimethylsilyl substituted boroles.
• Authors of publication: Heitkemper, Tobias; Naß, Leonard; Sindlinger, Christian P.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2020
• Journal volume: 49
• Journal issue: 8
• Pages of publication: 2706 - 2714
• a: 12.5487 ± 0.0009 Å
• b: 17.098 ± 0.0012 Å
• c: 21.7789 ± 0.0016 Å
• α: 79.764 ± 0.002°
• β: 87.198 ± 0.002°
• γ: 88.546 ± 0.002°
• Cell volume: 4592.3 ± 0.6 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: 0.0652
• Residual factor for significantly intense reflections: 0.0394
• Weighted residual factors for significantly intense reflections: 0.0824
• Weighted residual factors for all reflections included in the refinement: 0.0904
• Goodness-of-fit parameter for all reflections included in the refinement: 1.022
• Diffraction radiation wavelength: 0.56086 Å
• Diffraction radiation type: AgKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No