Information card for entry 4088913

Structure parameters

• Formula: C23 H38 N2 O3 P2 W
• Calculated formula: C23 H38 N2 O3 P2 W
• Title of publication: Arene C‒H Bond Coordination versus C‒H Bond Cleavage in Low-Valent Group 6 Carbonyl Pincer Complexes
• Authors of publication: de Aguiar, Sara R. M. M.; Stöger, Berthold; Pittenauer, Ernst; Allmaier, Günter; Veiros, Luis F.; Kirchner, Karl
• Journal of publication: Organometallics
• Year of publication: 2016
• Journal volume: 35
• Journal issue: 17
• Pages of publication: 3032
• a: 18.784 ± 0.013 Å
• b: 12.325 ± 0.008 Å
• c: 11.039 ± 0.007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2556 ± 3 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 6
• Space group number: 62
• Hermann-Mauguin space group symbol: P n m a
• Hall space group symbol: -P 2ac 2n
• Residual factor for all reflections: 0.0184
• Residual factor for significantly intense reflections: 0.0136
• Weighted residual factors for significantly intense reflections: 0.0185
• Weighted residual factors for all reflections included in the refinement: 0.0193
• Goodness-of-fit parameter for significantly intense reflections: 1.31
• Goodness-of-fit parameter for all reflections included in the refinement: 1.29
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No