Information card for entry 7047115

Structure parameters

• Formula: C22 H28 Cl N O Ru
• Calculated formula: C22 H28 Cl N O Ru
• Title of publication: Catalytic hydrogenation of carbonyl and nitro compounds using an [N,O]-chelate half-sandwich ruthenium catalyst.
• Authors of publication: Yao, Zi-Jian; Zhu, Jing-Wei; Lin, Nan; Qiao, Xin-Chao; Deng, Wei
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2019
• Journal volume: 48
• Journal issue: 21
• Pages of publication: 7158 - 7166
• a: 9.0862 ± 0.0005 Å
• b: 13.8263 ± 0.0008 Å
• c: 16.6951 ± 0.001 Å
• α: 90°
• β: 103.385 ± 0.003°
• γ: 90°
• Cell volume: 2040.4 ± 0.2 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0443
• Residual factor for significantly intense reflections: 0.0363
• Weighted residual factors for significantly intense reflections: 0.087
• Weighted residual factors for all reflections included in the refinement: 0.0922
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 1.34138 Å
• Diffraction radiation type: GaKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No