Information card for entry 4088521

Structure parameters

• Common name: hannr04
• Formula: C27 H63 As Si6
• Calculated formula: C27 H63 As Si6
• SMILES: [As]([C@H]([Si](C)(C)C)/C=C/[Si](C)(C)C)([C@@H]([Si](C)(C)C)/C=C/[Si](C)(C)C)[C@@H]([Si](C)(C)C)/C=C/[Si](C)(C)C.[As]([C@@H]([Si](C)(C)C)/C=C/[Si](C)(C)C)([C@H]([Si](C)(C)C)/C=C/[Si](C)(C)C)[C@H]([Si](C)(C)C)/C=C/[Si](C)(C)C
• Title of publication: Mechanochemical Influence on the Stereoselectivity of Halide Metathesis: Synthesis of Group 15 Tris(allyl) Complexes
• Authors of publication: Rightmire, Nicholas R.; Bruns, David L.; Hanusa, Timothy P.; Brennessel, William W.
• Journal of publication: Organometallics
• Year of publication: 2016
• Journal volume: 35
• Journal issue: 11
• Pages of publication: 1698
• a: 10.539 ± 0.002 Å
• b: 10.791 ± 0.002 Å
• c: 19.921 ± 0.004 Å
• α: 99.233 ± 0.004°
• β: 90.021 ± 0.004°
• γ: 118.479 ± 0.004°
• Cell volume: 1957.9 ± 0.7 ų
• Cell temperature: 100 ± 0.5 K
• Ambient diffraction temperature: 100 ± 0.5 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: 0.0915
• Residual factor for significantly intense reflections: 0.0493
• Weighted residual factors for significantly intense reflections: 0.0933
• Weighted residual factors for all reflections included in the refinement: 0.1067
• Goodness-of-fit parameter for all reflections included in the refinement: 1.011
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No