Information card for entry 4322796

Structure parameters

• Chemical name: cis,cis,cis-[dichloro-bis(dimethylsulfoxide)-(lutidine) (1,2-dimethylimidazole)-ruthenium(II)]
• Formula: C16 H29 Cl2 N3 O2 Ru S2
• Calculated formula: C16 H20 Cl2 N3 O2 Ru S2
• Title of publication: Crystals Containing Conformers: A Rare Case in Which a Solid Closely Reflects a Solution Equilibrium Mixture
• Authors of publication: Enzo Alessio; Ennio Zangrando; Romeo Roppa; Luigi G. Marzilli
• Journal of publication: Inorganic Chemistry
• Year of publication: 1998
• Journal volume: 37
• Pages of publication: 2458 - 2463
• a: 12.587 ± 0.002 Å
• b: 12.329 ± 0.003 Å
• c: 28.382 ± 0.005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4404.5 ± 1.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.093
• Residual factor for significantly intense reflections: 0.0429
• Weighted residual factors for all reflections: 0.1379
• Weighted residual factors for significantly intense reflections: 0.1085
• Goodness-of-fit parameter for all reflections: 1.285
• Goodness-of-fit parameter for significantly intense reflections: 1.273
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No