Information card for entry 4319910

Structure parameters

• Formula: C50 H44 Cl8 N4 O6 P Ru
• Calculated formula: C50 Cl8 N4 O6 P Ru
• Title of publication: Syntheses, Structures, and Physicochemical Properties of Diruthenium Compounds of Tetrachlorocatecholate with Metal-Metal Bonded Ru3+(μ-OR)2Ru3+ and Ru3.5+(μ-OR)2Ru3.5+ Cores (R = CH3 and C2H5)
• Authors of publication: Hitoshi Miyasaka; Ho-Chol Chang; Katsunori Mochizuki; Susumu Kitagawa
• Journal of publication: Inorganic Chemistry
• Year of publication: 2001
• Journal volume: 40
• Pages of publication: 3544 - 3554
• a: 17.874 ± 0.002 Å
• b: 13.565 ± 0.001 Å
• c: 21.841 ± 0.001 Å
• α: 90°
• β: 97.663 ± 0.002°
• γ: 90°
• Cell volume: 5248.3 ± 0.7 ų
• Cell temperature: 173.2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for significantly intense reflections: 0.0738
• Weighted residual factors for all reflections included in the refinement: 0.0756
• Goodness-of-fit parameter for all reflections included in the refinement: 1.322
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No