Information card for entry 4320791

Structure parameters

• Formula: C49 H40 P2 Ru Se
• Calculated formula: C52 H40 P2 Ru Se
• 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: 16.007 ± 0.004 Å
• b: 15.255 ± 0.003 Å
• c: 18.023 ± 0.004 Å
• α: 90°
• β: 108.62 ± 0.02°
• γ: 90°
• Cell volume: 4170.6 ± 1.7 ų
• Cell temperature: 296.2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for significantly intense reflections: 0.0396
• Weighted residual factors for all reflections included in the refinement: 0.0406
• Goodness-of-fit parameter for all reflections included in the refinement: 1.33
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No