Information card for entry 7037937

Structure parameters

• Formula: C37 H25 O6 P W
• Calculated formula: C37 H25 O6 P W
• SMILES: [W]([P@@]1(O[C@H](c2c1cccc2)c1ccccc1)C(c1ccccc1)(c1ccccc1)c1ccccc1)(C#[O])(C#[O])(C#[O])(C#[O])C#[O].[W]([P@]1(O[C@@H](c2c1cccc2)c1ccccc1)C(c1ccccc1)(c1ccccc1)c1ccccc1)(C#[O])(C#[O])(C#[O])(C#[O])C#[O]
• Title of publication: CPh3 as a functional group in P-heterocyclic chemistry: elimination of HCPh3 in the reaction of P-CPh3 substituted Li/Cl phosphinidenoid complexes with Ph2C[double bond, length as m-dash]O.
• Authors of publication: García, C Murcia; Ferao, A. Espinosa; Schnakenburg, G.; Streubel, R.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2016
• Journal volume: 45
• Journal issue: 6
• Pages of publication: 2378 - 2385
• a: 9.4174 ± 0.0014 Å
• b: 10.7473 ± 0.0014 Å
• c: 17.631 ± 0.002 Å
• α: 98.301 ± 0.004°
• β: 94.83 ± 0.004°
• γ: 112.865 ± 0.004°
• Cell volume: 1607.6 ± 0.4 ų
• Cell temperature: 123 K
• Ambient diffraction temperature: 123.15 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: 0.0893
• Residual factor for significantly intense reflections: 0.0498
• Weighted residual factors for significantly intense reflections: 0.0702
• Weighted residual factors for all reflections included in the refinement: 0.0809
• Goodness-of-fit parameter for all reflections included in the refinement: 0.962
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No