Information card for entry 7048321

Structure parameters

• Formula: C55 H52 Cl4 F3 N4 O3 P2 Rh Ru S
• Calculated formula: C55 H50 Cl4 F3 N4 O3 P2 Rh Ru S
• Title of publication: Bis(bipyridine) ruthenium(ii) bis(phosphido) metalloligand: synthesis of heterometallic complexes and application to catalytic (E)-selective alkyne semi-hydrogenation.
• Authors of publication: Takemoto, Shin; Kitamura, Manami; Saruwatari, Shuhei; Isono, Atsutaka; Takada, Yoko; Nishimori, Rie; Tsujiwaki, Mina; Sakaue, Naoki; Matsuzaka, Hiroyuki
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2019
• Journal volume: 48
• Journal issue: 4
• Pages of publication: 1161 - 1165
• a: 10.7935 ± 0.0006 Å
• b: 15.5987 ± 0.0009 Å
• c: 17.0524 ± 0.0011 Å
• α: 82.036 ± 0.006°
• β: 88.284 ± 0.006°
• γ: 74.438 ± 0.005°
• Cell volume: 2739 ± 0.3 ų
• Cell temperature: 173 K
• Ambient diffraction temperature: 173 K
• Number of distinct elements: 10
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.094
• Residual factor for significantly intense reflections: 0.0578
• Weighted residual factors for significantly intense reflections: 0.1328
• Weighted residual factors for all reflections included in the refinement: 0.1489
• Goodness-of-fit parameter for all reflections included in the refinement: 1.022
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No