Information card for entry 4331718

Structure parameters

• Formula: C28.5 H32.5 B Cl1.5 N6 O P S3 W
• Calculated formula: C28.5 H32 B Cl1.5 N6 O P S3 W
• Title of publication: π-Acid/π-Base Carbonyloxo, Carbonylsulfido, and Mixed-Valence Complexes of Tungsten
• Authors of publication: Thomas, Simon; Tiekink, Edward R. T.; Young, Charles G.
• Journal of publication: Inorganic Chemistry
• Year of publication: 2006
• Journal volume: 45
• Journal issue: 1
• Pages of publication: 352 - 361
• a: 32.242 ± 0.006 Å
• b: 41.145 ± 0.006 Å
• c: 10.352 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 13733 ± 6 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 K
• Number of distinct elements: 9
• Space group number: 43
• Hermann-Mauguin space group symbol: F d d 2
• Hall space group symbol: F 2 -2d
• Residual factor for all reflections: 0.055
• Residual factor for significantly intense reflections: 0.037
• Weighted residual factors for significantly intense reflections: 0.086
• Weighted residual factors for all reflections included in the refinement: 0.092
• Goodness-of-fit parameter for all reflections included in the refinement: 1.06
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKalpha
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No