Information card for entry 7250027

Structure parameters

• Formula: C28 H45 N O5
• Calculated formula: C28 H45 N O5
• Title of publication: Stability study and structural insights into cannabidiol cocrystals
• Authors of publication: Koryťáková, Adéla; Chatziadi, Argyro; Rohlíček, Jan; Zmeškalová, Eliška; Beránek, Josef; Šoóš, Miroslav
• Journal of publication: CrystEngComm
• Year of publication: 2025
• Journal volume: 27
• Journal issue: 14
• Pages of publication: 2154 - 2165
• a: 20.0237 ± 0.0006 Å
• b: 17.0222 ± 0.0005 Å
• c: 8.20215 ± 0.00019 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2795.68 ± 0.13 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 K
• Number of distinct elements: 4
• 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: 0.0699
• Residual factor for significantly intense reflections: 0.0675
• Weighted residual factors for all reflections: 0.0805
• Weighted residual factors for significantly intense reflections: 0.0803
• Goodness-of-fit parameter for all reflections: 4.6825
• Method of determination: powder diffraction
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54187 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No