Information card for entry 7249856

Structure parameters

• Formula: C9 H16 N3 O9 P
• Calculated formula: C9 H16 N3 O9 P
• Title of publication: Same but different: structural diversity of cytidine 5′-monophosphate (CMP) (an)hydrates
• Authors of publication: Kaszubowski, Oskar; Ślepokura, Katarzyna; Wojciechowski, Jakub
• Journal of publication: CrystEngComm
• Year of publication: 2025
• Journal volume: 27
• Journal issue: 8
• Pages of publication: 1174 - 1184
• a: 8.367 ± 0.002 Å
• b: 34.158 ± 0.007 Å
• c: 4.8236 ± 0.0009 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1378.6 ± 0.5 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.076
• Residual factor for significantly intense reflections: 0.0748
• Weighted residual factors for significantly intense reflections: 0.2101
• Weighted residual factors for all reflections included in the refinement: 0.2112
• Goodness-of-fit parameter for all reflections included in the refinement: 1.118
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No