Information card for entry 7246650

Structure parameters

• Chemical name: Famciclovir-fumaric acid (1:0.5)
• Formula: C32 H42 N10 O12
• Calculated formula: C32 H42 N10 O12
• Title of publication: Famciclovir–fumaric acid: an all-in-one multicomponent system with salt, cocrystal and salt–cocrystal continuum
• Authors of publication: Kotte, Lohith; Pendota, Vinusha; Sreedhar, Bojja; Nanubolu, Jagadeesh Babu
• Journal of publication: CrystEngComm
• Year of publication: 2023
• Journal volume: 25
• Journal issue: 17
• Pages of publication: 2662 - 2678
• a: 14.056 ± 0.004 Å
• b: 7.578 ± 0.003 Å
• c: 17.799 ± 0.007 Å
• α: 90°
• β: 106.96 ± 0.01°
• γ: 90°
• Cell volume: 1813.4 ± 1.1 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.091
• Residual factor for significantly intense reflections: 0.0524
• Weighted residual factors for significantly intense reflections: 0.1201
• Weighted residual factors for all reflections included in the refinement: 0.1466
• Goodness-of-fit parameter for all reflections included in the refinement: 1.05
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No