Information card for entry 7101977

Structure parameters

• Common name: Isopropylgalloxane
• Formula: C6 H15 Ga2 O3
• Calculated formula: C6 H11.8 Ga2 O3.32333
• Title of publication: Icosahedral galloxane clusters
• Authors of publication: McKinlay, Robert M.; Dalgarno, Scott J.; Nichols, Peter J.; Papadopoulos, Stavroula; Atwood, Jerry L.; Raston, Colin L.
• Journal of publication: Chemical Communications (Cambridge, United Kingdom)
• Year of publication: 2007
• Journal issue: 23
• Pages of publication: 2393 - 2395
• a: 19.044 ± 0.003 Å
• b: 19.044 ± 0.002 Å
• c: 19.044 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 6906.2 ± 1.4 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 4
• Space group number: 205
• Hermann-Mauguin space group symbol: P a -3
• Hall space group symbol: -P 2ac 2ab 3
• Residual factor for all reflections: 0.1027
• Residual factor for significantly intense reflections: 0.0661
• Weighted residual factors for significantly intense reflections: 0.1856
• Weighted residual factors for all reflections included in the refinement: 0.2064
• Goodness-of-fit parameter for all reflections included in the refinement: 1.08
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No