Information card for entry 4343029

Structure parameters

• Formula: C12 H30 In2 N24 O22 S4
• Calculated formula: C12 H28 In2 N24 O22 S4
• Title of publication: Coherent fusion of water array and protonated amine in a metal-sulfate-based coordination polymer for proton conduction.
• Authors of publication: Manna, Biplab; Anothumakkool, Bihag; Desai, Aamod V.; Samanta, Partha; Kurungot, Sreekumar; Ghosh, Sujit K.
• Journal of publication: Inorganic chemistry
• Year of publication: 2015
• Journal volume: 54
• Journal issue: 11
• Pages of publication: 5366 - 5371
• a: 10.8141 ± 0.0017 Å
• b: 13.092 ± 0.002 Å
• c: 27.175 ± 0.004 Å
• α: 90°
• β: 90.144 ± 0.003°
• γ: 90°
• Cell volume: 3847.4 ± 1 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.118
• Residual factor for significantly intense reflections: 0.0964
• Weighted residual factors for significantly intense reflections: 0.2504
• Weighted residual factors for all reflections included in the refinement: 0.2683
• Goodness-of-fit parameter for all reflections included in the refinement: 1.068
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No