Information card for entry 7703473

Structure parameters

• Formula: C50 H70 B2 Cl2 Si2
• Calculated formula: C50 H70 B2 Cl2 Si2
• 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: 12.0043 ± 0.0007 Å
• b: 20.473 ± 0.0012 Å
• c: 20.6672 ± 0.0012 Å
• α: 101.047 ± 0.003°
• β: 90.377 ± 0.003°
• γ: 91.41 ± 0.003°
• Cell volume: 4983.3 ± 0.5 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0909
• Residual factor for significantly intense reflections: 0.0648
• Weighted residual factors for significantly intense reflections: 0.1478
• Weighted residual factors for all reflections included in the refinement: 0.1613
• Goodness-of-fit parameter for all reflections included in the refinement: 1.032
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No