Information card for entry 7014133

Structure parameters

• Formula: C37 H33.5 Cl2 N8.5 O8 Ru
• Calculated formula: C37 H33.5 Cl2 N8.5 O8 Ru
• Title of publication: The synthesis and structure of heteroleptic tris(diimine)ruthenium(II) complexes.
• Authors of publication: Kepert, Christopher M.; Bond, Alan M.; Deacon, Glen B.; Spiccia, Leone; Skelton, Brian W.; White, Allan H.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2004
• Journal issue: 11
• Pages of publication: 1766 - 1774
• a: 29.007 ± 0.003 Å
• b: 11.068 ± 0.001 Å
• c: 23.383 ± 0.002 Å
• α: 90°
• β: 99.769 ± 0.001°
• γ: 90°
• Cell volume: 7398.2 ± 1.2 ų
• Cell temperature: 300 ± 2 K
• Ambient diffraction temperature: 300 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.096
• Residual factor for significantly intense reflections: 0.067
• Weighted residual factors for all reflections: 0.121
• Weighted residual factors for all reflections included in the refinement: 0.102
• Goodness-of-fit parameter for all reflections: 1.088
• Goodness-of-fit parameter for all reflections included in the refinement: 1.068
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No