Information card for entry 7027621

Structure parameters

• Formula: C44 H35 Cl3 N2 O P2 Ru
• Calculated formula: C44 H35 Cl3 N2 O P2 Ru
• Title of publication: Complexes of ruthenium with tridentate [P,N,O] ligands
• Authors of publication: Bhattacharyya, Pravat; Loza, Maria L.; Parr, Jonathan; Slawin, Alexandra M. Z.
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 1999
• Journal issue: 17
• Pages of publication: 2917
• a: 13.407 ± 0.0006 Å
• b: 15.4418 ± 0.0005 Å
• c: 20.7336 ± 0.0009 Å
• α: 90°
• β: 97.48 ± 0.001°
• γ: 90°
• Cell volume: 4255.9 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.3303
• Residual factor for significantly intense reflections: 0.1032
• Weighted residual factors for all reflections: 0.3947
• Weighted residual factors for significantly intense reflections: 0.2259
• Goodness-of-fit parameter for all reflections: 0.926
• Goodness-of-fit parameter for significantly intense reflections: 1.068
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No