Information card for entry 7156866

Structure parameters

• Formula: C9 H14 F2 O4
• Calculated formula: C9 H14 F2 O4
• Title of publication: Synthesis of vicinal dideoxy-difluorinated galactoses.
• Authors of publication: Malassis, Julien; Vendeville, Jean-Baptiste; Nguyen, Qui-Hien; Boujon, Marie; Gaignard-Gaillard, Quentin; Light, Mark; Linclau, Bruno
• Journal of publication: Organic & biomolecular chemistry
• Year of publication: 2019
• Journal volume: 17
• Journal issue: 21
• Pages of publication: 5331 - 5340
• a: 10.9535 ± 0.0005 Å
• b: 7.9162 ± 0.0003 Å
• c: 11.9942 ± 0.0005 Å
• α: 90°
• β: 98.836 ± 0.004°
• γ: 90°
• Cell volume: 1027.68 ± 0.08 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0477
• Residual factor for significantly intense reflections: 0.0404
• Weighted residual factors for significantly intense reflections: 0.0907
• Weighted residual factors for all reflections included in the refinement: 0.0943
• Goodness-of-fit parameter for all reflections included in the refinement: 1.041
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No