Information card for entry 4106764

Structure parameters

• Chemical name: (1RS,2SR,3SR,4RS)- 2,4-dichloro-2,4-dideoxy-1-O-(2,3-dinitrobenzoyl) -5-C-2-naphthyl-pentitol
• Formula: C23 H19 Cl4.5 N2 O9
• Calculated formula: C22.72 H18.72 Cl4.58 N2 O9
• Title of publication: Rapid, One-Pot Synthesis of β-Siloxy-α-haloaldehydes
• Authors of publication: Jakub Saadi; Matsujiro Akakura; Hisashi Yamamoto
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2011
• Journal volume: 133
• Pages of publication: 14248 - 14251
• a: 14.888 ± 0.006 Å
• b: 7.522 ± 0.003 Å
• c: 24.077 ± 0.009 Å
• α: 90°
• β: 93.645 ± 0.008°
• γ: 90°
• Cell volume: 2690.9 ± 1.8 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• 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: 0.1748
• Residual factor for significantly intense reflections: 0.0814
• Weighted residual factors for significantly intense reflections: 0.1873
• Weighted residual factors for all reflections included in the refinement: 0.2145
• Goodness-of-fit parameter for all reflections included in the refinement: 0.862
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No