Information card for entry 7046527

Structure parameters

• Formula: C5 H11 Cs O
• Calculated formula: C5 H11 Cs O
• Title of publication: The hetero-cubane structures of the heavy alkali metal tert-amyloxides [MOCMe₂Et]₄ (M = K, Rb, Cs).
• Authors of publication: Kaiser, Maximillian; Klett, Jan
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2018
• Journal volume: 47
• Journal issue: 36
• Pages of publication: 12582 - 12586
• a: 19.114 ± 0.003 Å
• b: 8.8747 ± 0.0015 Å
• c: 20.401 ± 0.003 Å
• α: 90°
• β: 117.105 ± 0.004°
• γ: 90°
• Cell volume: 3080.6 ± 0.8 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 4
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/c 1
• Hall space group symbol: -P 2yc
• Residual factor for all reflections: 0.0965
• Residual factor for significantly intense reflections: 0.0695
• Weighted residual factors for significantly intense reflections: 0.209
• Weighted residual factors for all reflections included in the refinement: 0.2364
• Goodness-of-fit parameter for all reflections included in the refinement: 1.151
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No