Information card for entry 4318244

Structure parameters

• Chemical name: mer-trichloro-bis(dimethylsulfoxide,O)-nitrosyl-ruthenium(III)
• Formula: C4 H12 Cl3 N O3 Ru S2
• Calculated formula: C4 H12 Cl3 N O3 Ru S2
• SMILES: [Ru](Cl)(Cl)(Cl)([O]=S(C)C)([O]=S(C)C)N=O
• Title of publication: Synthesis and Structural, Spectroscopic, and Electrochemical Characterization of New Ruthenium Dimethyl Sulfoxide Nitrosyls
• Authors of publication: Barbara Serli; Ennio Zangrando; Elisabetta Iengo; Giovanni Mestroni; Lesley Yellowlees; Enzo Alessio
• Journal of publication: Inorganic Chemistry
• Year of publication: 2002
• Journal volume: 41
• Pages of publication: 4033 - 4043
• a: 8.807 ± 0.002 Å
• b: 11.94 ± 0.002 Å
• c: 12.824 ± 0.002 Å
• α: 90°
• β: 104.245 ± 0.016°
• γ: 90°
• Cell volume: 1307.1 ± 0.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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 all reflections: 0.0875
• Residual factor for significantly intense reflections: 0.0417
• Weighted residual factors for significantly intense reflections: 0.0844
• Weighted residual factors for all reflections included in the refinement: 0.0934
• Goodness-of-fit parameter for all reflections included in the refinement: 0.936
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No