Information card for entry 4323920

Structure parameters

• Chemical name: Complex 2
• Formula: C22 H21 O5 Re W
• Calculated formula: C22 H21 O5 Re W
• Title of publication: Oxo Ligand Reactivity and Bonding in the Dinuclear W-Re Oxo-Acetylide Complex (η5-C5Me5)W(O)Re(CO)4(μ-H)(CCPh)
• Authors of publication: Hsiao-Ling Wu; Guey-Lin Lu; Yun Chi; Louis J. Farrugia; Shie-Ming Peng; Gene-Hsiang Lee
• Journal of publication: Inorganic Chemistry
• Year of publication: 1996
• Journal volume: 35
• Pages of publication: 6015 - 6020
• a: 8.1193 ± 0.0023 Å
• b: 18.7836 ± 0.0017 Å
• c: 14.6017 ± 0.0013 Å
• α: 90°
• β: 92.994 ± 0.016°
• γ: 90°
• Cell volume: 2223.9 ± 0.7 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 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 all reflections: 0.035
• Residual factor for significantly intense reflections: 0.027
• Weighted residual factors for all reflections: 0.027
• Weighted residual factors for significantly intense reflections: 0.027
• Goodness-of-fit parameter for significantly intense reflections: 1.93
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MolybdenumKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No