Information card for entry 2010808

Structure parameters

• Formula: C7 H10 F O7 P S
• Calculated formula: C7 H10 F O7 P S
• Title of publication: 4-Fluoro-2-(phosphonomethyl)benzenesulfonic acid monohydrate
• Authors of publication: Adani, Fabrizio; Montoneri, Enzo; Squattrito, Philip J.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2000
• Journal volume: 56
• Journal issue: 4
• Pages of publication: 463 - 464
• a: 8.486 ± 0.001 Å
• b: 9.247 ± 0.003 Å
• c: 7.917 ± 0.002 Å
• α: 104.84 ± 0.02°
• β: 110 ± 0.01°
• γ: 97.37 ± 0.02°
• Cell volume: 548.1 ± 0.3 ų
• Cell temperature: 296 K
• Ambient diffraction temperature: 296 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for significantly intense reflections: 0.044
• Weighted residual factors for all reflections included in the refinement: 0.064
• Goodness-of-fit parameter for all reflections included in the refinement: 1.98
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No