Information card for entry 7213026

Structure parameters

• Formula: C9 H14 Cl N3 O3
• Calculated formula: C9 H13 Cl N3 O3.5
• Title of publication: Convenient synthesis of C-aza-2,3-dideoxynucleosides
• Authors of publication: Momotake, Atsuya; Togo, Hideo; Yokoyama, Masataka
• Journal of publication: Journal of the Chemical Society, Perkin Transactions 1
• Year of publication: 1999
• Journal issue: 9
• Pages of publication: 1193
• a: 13.741 ± 0.001 Å
• b: 7.2 ± 0.0007 Å
• c: 24.483 ± 0.002 Å
• α: 90°
• β: 109.322 ± 0.005°
• γ: 90°
• Cell volume: 2285.8 ± 0.3 ų
• Cell temperature: 296.2 K
• Ambient diffraction temperature: 296.2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0672
• Residual factor for significantly intense reflections: 0.0672
• Weighted residual factors for significantly intense reflections: 0.0953
• Weighted residual factors for all reflections included in the refinement: 0.0953
• Goodness-of-fit parameter for all reflections included in the refinement: 4.318
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No