Information card for entry 7247859

Structure parameters

• Formula: C63 H70 Cl2 N2 O5 Ru2
• Calculated formula: C63 H70 Cl2 N2 O5 Ru2
• Title of publication: A highly active and chemoselective homobimetallic ruthenium catalyst for one-pot reductive amination in water
• Authors of publication: Deshmukh, Gopal; Rana, Thakur Rochak Kumar; Yadav, Nikita; Rajaraman, Gopalan; Murugavel, Ramaswamy
• Journal of publication: Green Chemistry
• Year of publication: 2024
• Journal volume: 26
• Journal issue: 3
• Pages of publication: 1610 - 1626
• a: 10.8293 ± 0.0013 Å
• b: 11.2973 ± 0.0014 Å
• c: 12.2048 ± 0.0014 Å
• α: 82.474 ± 0.004°
• β: 89.037 ± 0.004°
• γ: 78.85 ± 0.004°
• Cell volume: 1452.3 ± 0.3 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0635
• Residual factor for significantly intense reflections: 0.0555
• Weighted residual factors for significantly intense reflections: 0.1455
• Weighted residual factors for all reflections included in the refinement: 0.1523
• Goodness-of-fit parameter for all reflections included in the refinement: 1.119
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No