Information card for entry 7245724

Structure parameters

• Formula: C29 H36 N8 O3
• Calculated formula: C29 H36 N8 O3
• Title of publication: Solubility and permeability enhancement of BCS Class IV drug Ribociclib through cocrystallization
• Authors of publication: Mannava, Murali Krishna Chaitanya M.K.; Garai, Abhijit; Bommaka, Manish Kumar; Solomon, K. Anand; Nangia, Ashwini
• Journal of publication: CrystEngComm
• Year of publication: 2022
• a: 8.557 ± 0.0006 Å
• b: 29.967 ± 0.002 Å
• c: 11.5654 ± 0.0009 Å
• α: 90°
• β: 111.625 ± 0.002°
• γ: 90°
• Cell volume: 2757 ± 0.3 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/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1928
• Residual factor for significantly intense reflections: 0.0733
• Weighted residual factors for significantly intense reflections: 0.1584
• Weighted residual factors for all reflections included in the refinement: 0.2015
• Goodness-of-fit parameter for all reflections included in the refinement: 1.016
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No