Information card for entry 7226786

Structure parameters

• Formula: C53 H42 As2 Br Cl3 N2 O2 Ru
• Calculated formula: C53 H42 As2 Br Cl3 N2 O2 Ru
• Title of publication: Synthesis and characterisation of cycloruthenated benzhydrazone complexes: catalytic application to selective oxidative cleavage of olefins to aldehydes
• Authors of publication: Manikandan, Thimma Sambamoorthy; Ramesh, Rengan; Semeril, David
• Journal of publication: RSC Adv.
• Year of publication: 2016
• Journal volume: 6
• Journal issue: 99
• Pages of publication: 97107
• a: 15.2764 ± 0.001 Å
• b: 18.6423 ± 0.0012 Å
• c: 17.4632 ± 0.0012 Å
• α: 90°
• β: 95.039 ± 0.004°
• γ: 90°
• Cell volume: 4954.1 ± 0.6 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 8
• 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: 0.0752
• Residual factor for significantly intense reflections: 0.0487
• Weighted residual factors for significantly intense reflections: 0.1282
• Weighted residual factors for all reflections included in the refinement: 0.1489
• Goodness-of-fit parameter for all reflections included in the refinement: 1.043
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No