Information card for entry 4511911

Structure parameters

• Formula: C22 H29 Cl F N O7 S
• Calculated formula: C22 H29 Cl F N O7 S
• Title of publication: Stable Crystalline Salts of Haloperidol: A Highly Water-Soluble Mesylate Salt
• Authors of publication: Rajput, Lalit
• Journal of publication: Crystal Growth & Design
• Year of publication: 2014
• Journal volume: 14
• Journal issue: 10
• Pages of publication: 5196
• a: 9.5485 ± 0.0012 Å
• b: 10.3924 ± 0.0013 Å
• c: 13.2217 ± 0.0016 Å
• α: 107.554 ± 0.008°
• β: 98.463 ± 0.007°
• γ: 104.392 ± 0.007°
• Cell volume: 1176.1 ± 0.3 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0629
• Residual factor for significantly intense reflections: 0.0528
• Weighted residual factors for significantly intense reflections: 0.1519
• Weighted residual factors for all reflections included in the refinement: 0.163
• Goodness-of-fit parameter for all reflections included in the refinement: 1.074
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No