Information card for entry 4077900

Structure parameters

• Formula: C12 H8 O10 P2 W2
• Calculated formula: C12 H8 O10 P2 W2
• SMILES: C(#[O])[W](C#[O])(C#[O])(C#[O])([P@@H](C)[P@@H](C)[W](C#[O])(C#[O])(C#[O])(C#[O])C#[O])C#[O]
• Title of publication: Reaction of Terminal Phosphinidene Complexes with Dihydrogen
• Authors of publication: Duffy, Matthew P.; Ting, Liow Yu; Nicholls, Leo; Li, Yongxin; Ganguly, Rakesh; Mathey, François
• Journal of publication: Organometallics
• Year of publication: 2012
• Journal volume: 31
• Journal issue: 7
• Pages of publication: 2936
• a: 6.6181 ± 0.0002 Å
• b: 8.0445 ± 0.0002 Å
• c: 9.5458 ± 0.0002 Å
• α: 83.889 ± 0.001°
• β: 75.274 ± 0.001°
• γ: 75.041 ± 0.001°
• Cell volume: 474.41 ± 0.02 ų
• Cell temperature: 103 ± 2 K
• Ambient diffraction temperature: 103 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0134
• Residual factor for significantly intense reflections: 0.0127
• Weighted residual factors for significantly intense reflections: 0.0284
• Weighted residual factors for all reflections included in the refinement: 0.0311
• Goodness-of-fit parameter for all reflections included in the refinement: 1.145
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No