Information card for entry 7033081

Structure parameters

• Formula: C4.5 H14 Al B5 N2 O10
• Calculated formula: C4.5 Al B5 N2 O10
• Title of publication: Series of open-framework aluminoborates containing [B5O10] clusters.
• Authors of publication: Wei, Li; Wang, Guo-Ming; He, Huan; Yang, Bai-Feng; Yang, Guo-Yu
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2015
• Journal volume: 44
• Journal issue: 3
• Pages of publication: 1420 - 1426
• a: 9.59 ± 0.0005 Å
• b: 10.3214 ± 0.0006 Å
• c: 13.7988 ± 0.0009 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1365.84 ± 0.14 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0537
• Residual factor for significantly intense reflections: 0.0503
• Weighted residual factors for significantly intense reflections: 0.1275
• Weighted residual factors for all reflections included in the refinement: 0.1296
• Goodness-of-fit parameter for all reflections included in the refinement: 0.905
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No