Information card for entry 4323530

Structure parameters

• Chemical name: aqua(2,2'-bipyridine)dichloronitrosyl ruthenium(II) nitrate hydrate
• Formula: C10 H12 Cl2 N4 O6 Ru
• Calculated formula: C10 H12 Cl2 N4 O6 Ru
• SMILES: [Ru]1(Cl)(Cl)([OH2])([n]2ccccc2c2[n]1cccc2)N=O.N(=O)(=O)[O-].O
• Title of publication: Formation of Ruthenium Nitrosyl Complexes: Reactions of Ru(bpy)(CO)2Cl2 and Its Methyl-Substituted Analogues Ru(4,4'-dmbpy)(CO)2Cl2 and Ru(6,6'-dmbpy)(CO)2Cl2 in Oxidizing Acidic Solutions
• Authors of publication: Pertti Homanen; Matti Haukka; Markku Ahlgrén; Tapani A. Pakkanen
• Journal of publication: Inorganic Chemistry
• Year of publication: 1997
• Journal volume: 36
• Pages of publication: 3794 - 3797
• a: 10.57 ± 0.002 Å
• b: 11.226 ± 0.001 Å
• c: 13.976 ± 0.002 Å
• α: 90°
• β: 101.89 ± 0.01°
• γ: 90°
• Cell volume: 1622.8 ± 0.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0577
• Residual factor for significantly intense reflections: 0.0393
• Weighted residual factors for all reflections: 0.0963
• Weighted residual factors for significantly intense reflections: 0.0914
• Goodness-of-fit parameter for all reflections: 0.903
• Goodness-of-fit parameter for significantly intense reflections: 1.02
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No