Information card for entry 4080588

Structure parameters

• Formula: C24 H15 O11 P W2
• Calculated formula: C24 H15 O11 P W2
• SMILES: [W](C#[O])(C#[O])(C#[O])(C#[O])(C#[O])=C(C1=C(C)C(=C[P]1([W](C#[O])(C#[O])(C#[O])(C#[O])C#[O])c1ccccc1)C)OC
• Title of publication: The Original Reactivity of a Phosphole-Substituted Fischer Carbene Complex
• Authors of publication: Ng, Kim Hong; Li, Yongxin; Ganguly, Rakesh; Mathey, Francois
• Journal of publication: Organometallics
• Year of publication: 2013
• Journal volume: 32
• Journal issue: 8
• Pages of publication: 2287
• a: 9.8963 ± 0.0004 Å
• b: 11.8911 ± 0.0006 Å
• c: 12.3316 ± 0.0006 Å
• α: 85.551 ± 0.002°
• β: 89.254 ± 0.002°
• γ: 67.831 ± 0.002°
• Cell volume: 1339.62 ± 0.11 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: 0.0409
• Residual factor for significantly intense reflections: 0.0361
• Weighted residual factors for significantly intense reflections: 0.08
• Weighted residual factors for all reflections included in the refinement: 0.0826
• Goodness-of-fit parameter for all reflections included in the refinement: 1.204
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No