Information card for entry 7113136

Structure parameters

• Formula: Al19 H932 Mo132 N15 O928 S30
• Calculated formula: Al9.96 Mo132 O750.64 S30
• Title of publication: Cation behavior at an artificial cell interface: binding distinguished by ion hydration energetics and size.
• Authors of publication: Merca, Alice; Bögge, Hartmut; Schmidtmann, Marc; Zhou, Yunshan; Haupt, Erhard T. K.; Sarker, M. Khaled; Hill, Craig L.; Müller, Achim
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2008
• Journal issue: 8
• Pages of publication: 948 - 950
• a: 45.511 ± 0.002 Å
• b: 46.365 ± 0.002 Å
• c: 45.951 ± 0.002 Å
• α: 90°
• β: 90.014 ± 0.001°
• γ: 90°
• Cell volume: 96962 ± 7 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.1053
• Residual factor for significantly intense reflections: 0.0633
• Weighted residual factors for significantly intense reflections: 0.1625
• Weighted residual factors for all reflections included in the refinement: 0.1987
• Goodness-of-fit parameter for all reflections included in the refinement: 1.088
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No