Information card for entry 7046526

Structure parameters

• Formula: C5 H11 K O
• Calculated formula: C5 H11 K 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: 21.876 ± 0.004 Å
• b: 8.1807 ± 0.0017 Å
• c: 16.896 ± 0.003 Å
• α: 90°
• β: 111.919 ± 0.003°
• γ: 90°
• Cell volume: 2805.1 ± 0.9 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1173
• Residual factor for significantly intense reflections: 0.072
• Weighted residual factors for significantly intense reflections: 0.1446
• Weighted residual factors for all reflections included in the refinement: 0.1596
• Goodness-of-fit parameter for all reflections included in the refinement: 1.159
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No