Information card for entry 4337914

Structure parameters

• Formula: C48.75 H45.5 Cl1.5 N O4 P3 Ru
• Calculated formula: C48.75 H45.5 Cl1.5 N O4 P3 Ru
• Title of publication: Synthesis, Characterization, and Reactivity of Ruthenium Hydride Complexes of N-Centered Triphosphine Ligands.
• Authors of publication: Phanopoulos, Andreas; Brown, Neil J.; White, Andrew J. P.; Long, Nicholas J.; Miller, Philip W.
• Journal of publication: Inorganic chemistry
• Year of publication: 2014
• Journal volume: 53
• Journal issue: 7
• Pages of publication: 3742
• a: 12.1061 ± 0.0002 Å
• b: 16.2216 ± 0.0004 Å
• c: 24.8191 ± 0.0007 Å
• α: 100.354 ± 0.002°
• β: 101.124 ± 0.0019°
• γ: 105.082 ± 0.0019°
• Cell volume: 4479.6 ± 0.2 ų
• Cell temperature: 173 K
• Ambient diffraction temperature: 173 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: 0.0447
• Residual factor for significantly intense reflections: 0.0382
• Weighted residual factors for significantly intense reflections: 0.1002
• Weighted residual factors for all reflections included in the refinement: 0.1056
• Goodness-of-fit parameter for all reflections included in the refinement: 1.029
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No