Information card for entry 7705926

Structure parameters

• Chemical name: PJ-151
• Formula: C17 H10 Cl2 N O5 P W
• Calculated formula: C17 H10 Cl2 N O5 P W
• SMILES: [W]([P](Cl)(Cl)N(c1ccccc1)c1ccccc1)(C#[O])(C#[O])(C#[O])(C#[O])C#[O]
• Title of publication: A case study on the conversion of Li/Cl phosphinidenoid into phosphinidene complexes.
• Authors of publication: Junker, Philip; Qu, Zheng-Wang; Kalisch, Tim; Schnakenburg, Gregor; Espinosa Ferao, Arturo; Streubel, Rainer
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2021
• Journal volume: 50
• Journal issue: 2
• Pages of publication: 739 - 745
• a: 9.085 ± 0.005 Å
• b: 13.306 ± 0.008 Å
• c: 16.74 ± 0.011 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2024 ± 2 ų
• Cell temperature: 123 K
• Ambient diffraction temperature: 123 K
• Number of distinct elements: 7
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0318
• Residual factor for significantly intense reflections: 0.0257
• Weighted residual factors for significantly intense reflections: 0.0471
• Weighted residual factors for all reflections included in the refinement: 0.049
• Goodness-of-fit parameter for all reflections included in the refinement: 1.026
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No