Information card for entry 7013784

Structure parameters

• Common name: Ruthenium(iii) tris(2,2'-bipyridine-5,5'-dicarboxylic acid) 2.6-hydrate
• Formula: C36 H27 N6 O14.5 Ru
• Calculated formula: C36 H26 N6 O14.5 Ru
• Title of publication: Crystal structures of dicarboxy-2,2'-bipyridyl complexes: the role of hydrogen bonding and stacking interactions.
• Authors of publication: Matthews, Craig J.; Elsegood, Mark R. J.; Bernardinelli, Gérald; Clegg, William; Williams, Alan F.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2004
• Journal issue: 3
• Pages of publication: 492 - 497
• a: 14.605 ± 0.002 Å
• b: 12.503 ± 0.002 Å
• c: 19.601 ± 0.003 Å
• α: 90°
• β: 97.147 ± 0.004°
• γ: 90°
• Cell volume: 3551.5 ± 0.9 ų
• Cell temperature: 160 ± 2 K
• Ambient diffraction temperature: 160 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: I 1 2/a 1
• Hall space group symbol: -I 2ya
• Residual factor for all reflections: 0.1005
• Residual factor for significantly intense reflections: 0.0582
• Weighted residual factors for significantly intense reflections: 0.0889
• Weighted residual factors for all reflections included in the refinement: 0.1006
• 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