Information card for entry 2312527

Structure parameters

• Chemical name: Carbonylhydrido(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>)bis(triphenylphosphane-κ<i>P</i>)ruthenium(II) hexafluoridophosphate
• Formula: C49 H39 F6 N2 O P3 Ru
• Calculated formula: C49 H39 F6 N2 O P3 Ru
• Title of publication: Synthesis and structural characterizations of three carbonyl(α-diimine)hydrido(triphenylphosphine)ruthenium(II) complexes with derivatives of 1,10-phenanthroline.
• Authors of publication: Wysocki, Waldemar; Kamecka, Anna; Karczmarzyk, Zbigniew
• Journal of publication: Acta crystallographica. Section C, Structural chemistry
• Year of publication: 2024
• Journal volume: 80
• Journal issue: Pt 7
• Pages of publication: 319 - 330
• a: 10.5442 ± 0.0006 Å
• b: 21.1741 ± 0.0013 Å
• c: 21.9326 ± 0.0013 Å
• α: 90°
• β: 97.528 ± 0.005°
• γ: 90°
• Cell volume: 4854.6 ± 0.5 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.1197
• Residual factor for significantly intense reflections: 0.0596
• Weighted residual factors for significantly intense reflections: 0.1175
• Weighted residual factors for all reflections included in the refinement: 0.146
• Goodness-of-fit parameter for all reflections included in the refinement: 1.022
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes