Information card for entry 7217308

Structure parameters

• Chemical name: Cabazitaxel ethanol solvate hemihydrate
• Formula: C47 H63 N O15.5
• Calculated formula: C47 H63 N O15.5
• Title of publication: Towards understanding P-gp resistance: a case study of the antitumour drug cabazitaxel
• Authors of publication: Baisch, U.; Vella-Zarb, L.
• Journal of publication: CrystEngComm
• Year of publication: 2014
• Journal volume: 16
• Journal issue: 44
• Pages of publication: 10161
• a: 12.542 ± 0.002 Å
• b: 8.6716 ± 0.0016 Å
• c: 42.09 ± 0.008 Å
• α: 90°
• β: 89.987 ± 0.002°
• γ: 90°
• Cell volume: 4577.7 ± 1.4 ų
• Cell temperature: 120.15 K
• Ambient diffraction temperature: 120.15 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: 0.0575
• Residual factor for significantly intense reflections: 0.0549
• Weighted residual factors for significantly intense reflections: 0.143
• Weighted residual factors for all reflections included in the refinement: 0.1456
• Goodness-of-fit parameter for all reflections included in the refinement: 1.101
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.6889 Å
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No