Information card for entry 7119164

Structure parameters

• Chemical name: piroxicam methanol solvate
• Formula: C46 H43 N9 O13 S3
• Calculated formula: C46 H43 N9 O13 S3
• Title of publication: Selective preparation of elusive and alternative single component polymorphic solid forms through multi-component crystallisation routes
• Authors of publication: Lynne H. Thomas; Craig Wales; Chick C. Wilson
• Journal of publication: Chem.Commun.
• Year of publication: 2016
• Journal volume: 52
• Pages of publication: 7372
• a: 7.0374 ± 0.0019 Å
• b: 12.917 ± 0.004 Å
• c: 25.467 ± 0.008 Å
• α: 84.077 ± 0.007°
• β: 89.174 ± 0.007°
• γ: 83.327 ± 0.006°
• Cell volume: 2287 ± 1.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.3371
• Residual factor for significantly intense reflections: 0.2271
• Weighted residual factors for significantly intense reflections: 0.4776
• Weighted residual factors for all reflections included in the refinement: 0.5325
• Goodness-of-fit parameter for all reflections included in the refinement: 1.44
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No