Information card for entry 7013201

Structure parameters

• Formula: C46 H64 B Cl5 F4 N O2 P3 Ru S
• Calculated formula: C46 H64 B Cl5 F4 N O2 P3 Ru S
• Title of publication: Synthesis, reactivity and catalytic activity in transfer hydrogenation of ketones of ruthenium(II) and ruthenium(IV) complexes containing the novel N-thiophosphorylated iminophosphorane-phosphine ligands Ph2PCH2P{NP(S)(OR)2}Ph2(R = Et, Ph)
• Authors of publication: Victorio Cadierno; Pascale Crochet; Josefina Díez; Joaquín García-Álvarez; Sergio E. García-Garrido; Santiago García-Granda; José Gimeno; Miguel A. Rodríguez
• Journal of publication: Dalton Trans.
• Year of publication: 2003
• Journal issue: 16
• Pages of publication: 3240 - 3249
• a: 12.1739 ± 0.0006 Å
• b: 23.8656 ± 0.0009 Å
• c: 21.132 ± 0.0008 Å
• α: 90°
• β: 125 ± 0.09°
• γ: 90°
• Cell volume: 5029 ± 6 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 10
• 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: 0.0863
• Residual factor for significantly intense reflections: 0.0708
• Weighted residual factors for significantly intense reflections: 0.2102
• Weighted residual factors for all reflections included in the refinement: 0.2525
• Goodness-of-fit parameter for all reflections included in the refinement: 1.09
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No