Information card for entry 4022632

Structure parameters

• Formula: C10 H10 F2 N2 O4
• Calculated formula: C10 H10 F2 N2 O4
• SMILES: C1(=O)C=CN(C(=O)N1)[C@H]1C[C@H]2[C@](CO)(C2(F)F)O1
• Title of publication: Addition of Difluorocarbene to 3',4'-Unsaturated Nucleosides: Synthesis of 2'-Deoxy Analogues with a 2-Oxabicyclo[3.1.0]hexane Framework
• Authors of publication: Ireneusz Nowak; John F. Cannon; Morris J. Robins
• Journal of publication: Journal of Organic Chemistry
• Year of publication: 2007
• Journal volume: 72
• Pages of publication: 532 - 537
• a: 6.5347 ± 0.0006 Å
• b: 7.0844 ± 0.0007 Å
• c: 11.655 ± 0.0011 Å
• α: 90°
• β: 96.388 ± 0.007°
• γ: 90°
• Cell volume: 536.21 ± 0.09 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0419
• Residual factor for significantly intense reflections: 0.0349
• Weighted residual factors for significantly intense reflections: 0.085
• Weighted residual factors for all reflections included in the refinement: 0.0883
• Goodness-of-fit parameter for all reflections included in the refinement: 1.046
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No