Information card for entry 4320794

Structure parameters

• Formula: C20 H20 O P Ru S Zr
• Calculated formula: C45 H42.5 O P Ru S Zr
• Title of publication: Alkynethiolato and Alkyneselenolato Ruthenium Half-Sandwich Complexes: Synthesis, Structures, and Reactions with (η5-C5H5)2Zr
• Authors of publication: Yusuke Sunada; Yuji Hayashi; Hiroyuki Kawaguchi; Kazuyuki Tatsumi
• Journal of publication: Inorganic Chemistry
• Year of publication: 2001
• Journal volume: 40
• Pages of publication: 7072 - 7078
• a: 8.1073 ± 0.0006 Å
• b: 13.635 ± 0.001 Å
• c: 18.153 ± 0.001 Å
• α: 111.993 ± 0.0006°
• β: 97.3595 ± 0.0008°
• γ: 92.0565 ± 0.0009°
• Cell volume: 1837.7 ± 0.2 ų
• Cell temperature: 273.2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for significantly intense reflections: 0.0483
• Weighted residual factors for all reflections included in the refinement: 0.063
• Goodness-of-fit parameter for all reflections included in the refinement: 1.723
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No