Information card for entry 2243175

Structure parameters

• Chemical name: Silver potassium 4-carboxybenzenesulfonate
• Formula: C7 H5 Ag0.69 K0.31 O5 S
• Calculated formula: C7 H5 Ag0.69 K0.31 O5 S
• Title of publication: Crystal structures of two coordination isomers of copper(II) 4-sulfobenzoic acid hexahydrate and two mixed silver/potassium 4-sulfobenzoic acid salts
• Authors of publication: Squattrito, Philip J.; Lambright-Mutthamsetty, Kelly J.; Giolando, Patrick A.; Kirschbaum, Kristin
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2019
• Journal volume: 75
• Journal issue: 11
• Pages of publication: 1801 - 1807
• a: 19.436 ± 0.003 Å
• b: 15.644 ± 0.003 Å
• c: 5.3355 ± 0.0009 Å
• α: 90°
• β: 95.651 ± 0.002°
• γ: 90°
• Cell volume: 1614.4 ± 0.5 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0205
• Residual factor for significantly intense reflections: 0.0168
• Weighted residual factors for significantly intense reflections: 0.0413
• Weighted residual factors for all reflections included in the refinement: 0.0427
• Goodness-of-fit parameter for all reflections included in the refinement: 1.079
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes