Information card for entry 7006173

Structure parameters

• Formula: C32 H28 N6 O8 Ru
• Calculated formula: C32 H28 N6 O8 Ru
• Title of publication: Expanded ligands: bis(2,2':6',2''-terpyridine carboxylic acid)ruthenium(ii) complexes as metallosupramolecular analogues of dicarboxylic acids.
• Authors of publication: Constable, Edwin C.; Dunphy, Emma L.; Housecroft, Catherine E.; Neuburger, Markus; Schaffner, Silvia; Schaper, Frank; Batten, Stuart R.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2007
• Journal issue: 38
• Pages of publication: 4323 - 4332
• a: 8.6013 ± 0.0004 Å
• b: 8.6013 ± 0.0004 Å
• c: 40.0329 ± 0.0016 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2961.7 ± 0.2 ų
• Cell temperature: 173 K
• Ambient diffraction temperature: 173 K
• Number of distinct elements: 5
• Space group number: 122
• Hermann-Mauguin space group symbol: I -4 2 d
• Hall space group symbol: I -4 2bw
• Residual factor for all reflections: 0.0414
• Residual factor for significantly intense reflections: 0.0208
• Weighted residual factors for all reflections: 0.0297
• Weighted residual factors for significantly intense reflections: 0.0217
• Weighted residual factors for all reflections included in the refinement: 0.0217
• Goodness-of-fit parameter for all reflections included in the refinement: 1.0798
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No