Information card for entry 4502712

Structure parameters

• Common name: didanosine
• Chemical name: 2',3'-dideoxyinosine 0.125-hydrate
• Formula: C10 H12.25 N4 O3.125
• Calculated formula: C10 H12 N4 O3.125
• Title of publication: Solvothermal Preparation of Drug Crystals: Didanosine
• Authors of publication: Martins, Felipe T.; Legendre, Alexandre O.; Honorato, Sara B.; Ayala, Alejandro P.; Doriguetto, Antônio C.; Ellena, Javier
• Journal of publication: Crystal Growth & Design
• Year of publication: 2010
• Journal volume: 10
• Journal issue: 4
• Pages of publication: 1885
• a: 7.277 ± 0.001 Å
• b: 10.052 ± 0.002 Å
• c: 14.476 ± 0.003 Å
• α: 90°
• β: 93.71 ± 0.01°
• γ: 90°
• Cell volume: 1056.7 ± 0.3 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: 0.0945
• Residual factor for significantly intense reflections: 0.0583
• Weighted residual factors for significantly intense reflections: 0.1269
• Weighted residual factors for all reflections included in the refinement: 0.1456
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No