Information card for entry 7014239

Structure parameters

• Formula: C83 H60 Br2 N4 O4 P2 Ru
• Calculated formula: C83 H60 Br2 N4 O4 P2 Ru
• Title of publication: Ruthenium bipyridyl compounds with two terminal alkynyl ligands.
• Authors of publication: Adams, Christopher J.; Bowen, Lucy E.; Humphrey, Mark G.; Morrall, Joseph P. L.; Samoc, Marek; Yellowlees, Lesley J.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2004
• Journal issue: 24
• Pages of publication: 4130 - 4138
• a: 11.939 ± 0.003 Å
• b: 13.588 ± 0.002 Å
• c: 24.678 ± 0.004 Å
• α: 82.868 ± 0.017°
• β: 84.101 ± 0.016°
• γ: 64.082 ± 0.015°
• Cell volume: 3567.6 ± 1.3 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1084
• Residual factor for significantly intense reflections: 0.0503
• Weighted residual factors for significantly intense reflections: 0.113
• Weighted residual factors for all reflections included in the refinement: 0.1338
• Goodness-of-fit parameter for all reflections included in the refinement: 1.032
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No