Information card for entry 4301508

Structure parameters

• Formula: C26 H26 N8 O Ru
• Calculated formula: C26 H26 N8 O Ru
• Title of publication: Halogen Bonded Supramolecular Assemblies of [Ru(bipy)(CN)4]2- Anions and N-Methyl-Halopyridinium Cations in the Solid State and in Solution
• Authors of publication: Sofia Derossi; Lee Brammer; Christopher A. Hunter; Michael D. Ward
• Journal of publication: Inorganic Chemistry
• Year of publication: 2009
• Journal volume: 48
• Pages of publication: 1666 - 1677
• a: 8.8686 ± 0.0006 Å
• b: 32.668 ± 0.002 Å
• c: 9.2236 ± 0.0007 Å
• α: 90°
• β: 114.48 ± 0.004°
• γ: 90°
• Cell volume: 2432 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0774
• Residual factor for significantly intense reflections: 0.0446
• Weighted residual factors for significantly intense reflections: 0.0963
• Weighted residual factors for all reflections included in the refinement: 0.1052
• Goodness-of-fit parameter for all reflections included in the refinement: 0.899
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No