Information card for entry 4087368

Structure parameters

• Formula: C27 H25 Cl2 P Ru
• Calculated formula: C27 H25 Cl2 P Ru
• SMILES: [Ru]123456(Cl)(Cl)[P@@](c7c([c]84[cH]3[cH]2[c]1([cH]6[cH]58)c1ccccc1)cccc7)(c1ccccc1)C(C)C
• Title of publication: Mild Photochemical Tethering of [RuCl2(η6-arene)P*] Complexes with P-Stereogenic 2-Biphenylylphosphines
• Authors of publication: Navarro, Miquel; Vidal, Diego; Clavero, Pau; Grabulosa, Arnald; Muller, Guillermo
• Journal of publication: Organometallics
• Year of publication: 2015
• Journal volume: 34
• Journal issue: 5
• Pages of publication: 973
• a: 11.7604 ± 0.0009 Å
• b: 13.4167 ± 0.001 Å
• c: 14.2493 ± 0.0009 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2248.3 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.021
• Residual factor for significantly intense reflections: 0.0194
• Weighted residual factors for significantly intense reflections: 0.0488
• Weighted residual factors for all reflections included in the refinement: 0.0495
• Goodness-of-fit parameter for all reflections included in the refinement: 1.13
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No