Information card for entry 4343625

Structure parameters

• Formula: C28 H8 Au N4 S16
• Calculated formula: C28 H8 Au N4 S16
• Title of publication: Dithiophene-TTF Salts; New Ladder Structures and Spin-Ladder Behavior.
• Authors of publication: Silva, Rafaela A. L.; Santos, Isabel C.; Wright, Jonathan; Coutinho, Joana T.; Pereira, Laura C. J.; Lopes, Elsa B.; Rabaça, Sandra; Vidal-Gancedo, José; Rovira, Concepció; Almeida, Manuel; Belo, Dulce
• Journal of publication: Inorganic chemistry
• Year of publication: 2015
• Journal volume: 54
• Journal issue: 14
• Pages of publication: 7000 - 7006
• a: 17.1678 ± 0.0009 Å
• b: 3.8756 ± 0.0002 Å
• c: 26.0522 ± 0.0011 Å
• α: 90°
• β: 100.208 ± 0.002°
• γ: 90°
• Cell volume: 1705.96 ± 0.15 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• 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: 0.0494
• Residual factor for significantly intense reflections: 0.0312
• Weighted residual factors for significantly intense reflections: 0.0618
• Weighted residual factors for all reflections included in the refinement: 0.0651
• Goodness-of-fit parameter for all reflections included in the refinement: 0.965
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No