Information card for entry 2013720

Structure parameters

• Formula: C4 H12 B2 F2 Ge3 N2 O9
• Calculated formula: C4 H12 B2 F2 Ge3 N2 O9
• Title of publication: (C~4~N~2~H~12~)[(GeO~2~)~3~(BO~1.5~F)~2~], a layered borogermanate containing three- and nine-membered rings
• Authors of publication: Li, Yang-feng; Zou, Xiaodong
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2003
• Journal volume: 59
• Journal issue: 11
• Pages of publication: m471 - m472
• a: 6.9776 ± 0.0014 Å
• b: 11.779 ± 0.002 Å
• c: 15.997 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1314.8 ± 0.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 60
• Hermann-Mauguin space group symbol: P b c n
• Hall space group symbol: -P 2n 2ab
• Residual factor for all reflections: 0.0254
• Residual factor for significantly intense reflections: 0.0192
• Weighted residual factors for significantly intense reflections: 0.0442
• Weighted residual factors for all reflections included in the refinement: 0.0455
• Goodness-of-fit parameter for all reflections included in the refinement: 1
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes