Information card for entry 4087365

Structure parameters

• Formula: C25 H26 B P
• Calculated formula: C25 H26 B P
• SMILES: [P@](c1ccccc1c1cccc2ccccc12)(c1ccccc1)(C(C)C)[BH3]
• 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: 22.0645 ± 0.0013 Å
• b: 22.0645 ± 0.0013 Å
• c: 11.2385 ± 0.0007 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 4738.4 ± 0.5 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 145
• Hermann-Mauguin space group symbol: P 32
• Hall space group symbol: P 32
• Residual factor for all reflections: 0.1091
• Residual factor for significantly intense reflections: 0.0656
• Weighted residual factors for significantly intense reflections: 0.147
• Weighted residual factors for all reflections included in the refinement: 0.1687
• Goodness-of-fit parameter for all reflections included in the refinement: 0.97
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No