Information card for entry 7109870

Structure parameters

• Formula: C19 H51 O P Si4 W
• Calculated formula: C19 H51 O P Si4 W
• SMILES: C([Si](C)(C)C)[W](C[Si](C)(C)C)(C[Si](C)(C)C)([O]=P(C)(C)C)#C[Si](C)(C)C
• Title of publication: Reactions of d0 tungsten alkylidyne complexes with O2 or H2O. Formation of an oxo siloxy complex through unusual silyl migrations
• Authors of publication: Laurel A. Morton; Maozhong Miao; Tabitha M. Callaway; Tianniu Chen; Shu-Jian Chen; Albert A. Tuinman; Xianghua Yu; Zheng Lu; Zi-Ling Xue
• Journal of publication: Chem.Commun.
• Year of publication: 2013
• Journal volume: 49
• Pages of publication: 9555
• a: 17.903 ± 0.004 Å
• b: 10.516 ± 0.002 Å
• c: 17.191 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3236.5 ± 1.2 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.067
• Residual factor for significantly intense reflections: 0.0374
• Weighted residual factors for significantly intense reflections: 0.0695
• Weighted residual factors for all reflections included in the refinement: 0.0782
• Goodness-of-fit parameter for all reflections included in the refinement: 1.093
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No