Information card for entry 4115000

Structure parameters

• Common name: trans-[Ru(II)(NH3)4Cl(SO2)]Cl
• Chemical name: trans-Tetraamminechloro(sulfur dioxide)ruthenium(II) chloride
• Formula: Cl2 H12 N4 O2 Ru S
• Calculated formula: Cl2 H12 N4 O2 Ru S
• Title of publication: The First Photocrystallographic Evidence for Light-Induced Metastable Linkage Isomers of Ruthenium Sulfur Dioxide Complexes
• Authors of publication: Andrey Yu. Kovalevsky; Kimberly A. Bagley; Philip Coppens
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2002
• Journal volume: 124
• Pages of publication: 9241 - 9248
• a: 13.8336 ± 0.0008 Å
• b: 7.2918 ± 0.0004 Å
• c: 9.2037 ± 0.0006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 928.39 ± 0.1 ų
• Cell temperature: 90 ± 1 K
• Ambient diffraction temperature: 90 ± 1 K
• Number of distinct elements: 6
• Space group number: 62
• Hermann-Mauguin space group symbol: P n m a
• Hall space group symbol: -P 2ac 2n
• Residual factor for all reflections: 0.0389
• Residual factor for significantly intense reflections: 0.0299
• Weighted residual factors for significantly intense reflections: 0.0666
• Weighted residual factors for all reflections included in the refinement: 0.0696
• Goodness-of-fit parameter for all reflections included in the refinement: 1.286
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No