Information card for entry 7104628

Structure parameters

• Formula: C33 H35 Cl3 N6 O6 Ru
• Calculated formula: C33 H35 Cl3 N6 O6 Ru
• Title of publication: First structurally characterized mono- and dinuclear ruthenium complexes derived from zwitterionic quinonoid ligands.
• Authors of publication: Das, Hari Sankar; Das, Atanu Kumar; Pattacini, Roberto; Hübner, Ralph; Sarkar, Biprajit; Braunstein, Pierre
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2009
• Journal volume: 34
• Journal issue: 29
• Pages of publication: 4387 - 4389
• a: 9.8944 ± 0.0002 Å
• b: 18.0252 ± 0.0002 Å
• c: 19.8545 ± 0.0003 Å
• α: 90°
• β: 99.26 ± 0.001°
• γ: 90°
• Cell volume: 3494.87 ± 0.1 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0539
• Residual factor for significantly intense reflections: 0.0365
• Weighted residual factors for significantly intense reflections: 0.1088
• Weighted residual factors for all reflections included in the refinement: 0.1271
• Goodness-of-fit parameter for all reflections included in the refinement: 1.169
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No