Information card for entry 4316170

Structure parameters

• Common name: CS2(TTF-TC)H2
• Chemical name: dicesiumtetrathiafulvalenedicarboxylic)dicarboxylate
• Formula: C10 H2 Cs2 O8 S4
• Calculated formula: C10 H2 Cs2 O8 S4
• Title of publication: 3-D Coordination Polymers Based on the Tetrathiafulvalenetetracarboxylate (TTF-TC) Derivative: Synthesis, Characterization, and Oxidation Issues
• Authors of publication: Thi Le Anh Nguyen; Rezan Demir-Cakan; Thomas Devic; Mathieu Morcrette; Tim Ahnfeldt; Pascale Auban-Senzier; Norbert Stock; Anne-Marie Goncalves; Yaroslav Filinchuk; Jean-Marie Tarascon; Gérard Férey
• Journal of publication: Inorganic Chemistry
• Year of publication: 2010
• Journal volume: 49
• Pages of publication: 7135 - 7143
• a: 9.992 ± 0.003 Å
• b: 16.77 ± 0.004 Å
• c: 5.9356 ± 0.0015 Å
• α: 90°
• β: 123.39 ± 0.004°
• γ: 90°
• Cell volume: 830.4 ± 0.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 12
• Hermann-Mauguin space group symbol: C 1 2/m 1
• Hall space group symbol: -C 2y
• Residual factor for all reflections: 0.0498
• Residual factor for significantly intense reflections: 0.0443
• Weighted residual factors for significantly intense reflections: 0.0906
• Weighted residual factors for all reflections included in the refinement: 0.0926
• Goodness-of-fit parameter for all reflections included in the refinement: 1.164
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No