Information card for entry 7702442

Structure parameters

• Common name: (Ru(H2dcbpy))Cl2.2 3/4H2O
• Formula: C36 H29.5 Cl2 N6 O14.75 Ru
• Calculated formula: C36 H29.5 Cl2 N6 O14.75 Ru
• Title of publication: Redox and photochemical behaviour of ruthenium(II) complexes with H2dcbpy ligand (H2dcbpy = 2,2′-bipyridine-4,4′-dicarboxylic acid)
• Authors of publication: Eskelinen, Esa; Luukkanen, Saija; Haukka, Matti; Ahlgrén, Markku; Pakkanen, Tapani A.
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 2000
• Journal issue: 16
• Pages of publication: 2745
• a: 22.1485 ± 0.0003 Å
• b: 18.7892 ± 0.0003 Å
• c: 21.4865 ± 0.0002 Å
• α: 90°
• β: 118.593 ± 0.001°
• γ: 90°
• Cell volume: 7851.15 ± 0.19 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• Space group number: 9
• Hermann-Mauguin space group symbol: C 1 c 1
• Hall space group symbol: C -2yc
• Residual factor for all reflections: 0.0265
• Residual factor for significantly intense reflections: 0.0249
• Weighted residual factors for significantly intense reflections: 0.0624
• Weighted residual factors for all reflections included in the refinement: 0.0634
• Goodness-of-fit parameter for all reflections included in the refinement: 1.041
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No