Information card for entry 4064473

Structure parameters

• Formula: C31 H50 Cl3 P2 Ru Zr
• Calculated formula: C31 H43 Cl3 P2 Ru Zr
• Title of publication: Synthesis of Group IV (Zr, Hf)−Group VIII (Fe, Ru) Heterobimetallic Complexes Bearing Metallocenyl Diphosphine Moieties and Their Application to Catalytic Dehydrogenation of Amine−Boranes
• Authors of publication: Miyazaki, Takamasa; Tanabe, Yoshiaki; Yuki, Masahiro; Miyake, Yoshihiro; Nishibayashi, Yoshiaki
• Journal of publication: Organometallics
• Year of publication: 2011
• Journal volume: 30
• Journal issue: 8
• Pages of publication: 2394
• a: 8.4062 ± 0.0004 Å
• b: 10.6464 ± 0.0006 Å
• c: 19.865 ± 0.0009 Å
• α: 81.895 ± 0.002°
• β: 86.898 ± 0.0012°
• γ: 88.501 ± 0.0019°
• Cell volume: 1757.19 ± 0.15 ų
• Cell temperature: 294.1 K
• Ambient diffraction temperature: 294.1 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 significantly intense reflections: 0.036
• Weighted residual factors for all reflections included in the refinement: 0.0713
• Goodness-of-fit parameter for all reflections included in the refinement: 1
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No