Information card for entry 7011878

Structure parameters

• Common name: [Ag2(1,3-[6]aneS2)SO4].3H2O
• Chemical name: 1,3-dithiacyclohexane bis(silver) sulphate trihydrate
• Formula: C4 H14 Ag2 O7 S3
• Calculated formula: C4 H10 Ag2 O7 S3
• Title of publication: Bridging mode flexibility of 1,3-dithiacyclohexane in silver(i) co-ordination polymers
• Authors of publication: Brammer, Lee; Rodger, Colin S.; Blake, Alexander J.; Brooks, Neil R.; Champness, Neil R.; Cunningham, John W.; Hubberstey, Peter; Teat, Simon J.; Wilson, Claire; Schröder, Martin
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 2002
• Journal issue: 22
• Pages of publication: 4134
• a: 22.876 ± 0.002 Å
• b: 7.0102 ± 0.0005 Å
• c: 16.8656 ± 0.0013 Å
• α: 90°
• β: 116.449 ± 0.002°
• γ: 90°
• Cell volume: 2421.6 ± 0.3 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• 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: 0.0472
• Residual factor for significantly intense reflections: 0.0383
• Weighted residual factors for significantly intense reflections: 0.0976
• Weighted residual factors for all reflections included in the refinement: 0.1008
• Goodness-of-fit parameter for all reflections included in the refinement: 1.126
• Diffraction radiation wavelength: 0.6891 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No