Information card for entry 7129359

Structure parameters

• Formula: C26 H36 B Cl Si2
• Calculated formula: C26 H36 B Cl Si2
• SMILES: ClB1C([Si](C)(C)C)=C(C(=C1[Si](C)(C)C)c1cc(cc(C)c1)C)c1cc(cc(c1)C)C
• Title of publication: Borole-based half-sandwich complexes of germanium and tin
• Authors of publication: Sarcevic, Julijan; Heitkemper, Tobias; Sindlinger, Christian P.
• Journal of publication: Chemical Communications
• Year of publication: 2021
• a: 9.2086 ± 0.001 Å
• b: 11.0462 ± 0.0012 Å
• c: 14.4968 ± 0.0016 Å
• α: 111.74 ± 0.002°
• β: 94.288 ± 0.002°
• γ: 96.866 ± 0.002°
• Cell volume: 1348.5 ± 0.3 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: 0.0357
• Residual factor for significantly intense reflections: 0.0315
• Weighted residual factors for significantly intense reflections: 0.0877
• Weighted residual factors for all reflections included in the refinement: 0.0909
• Goodness-of-fit parameter for all reflections included in the refinement: 1.033
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No