Information card for entry 7709461

Structure parameters

• Chemical name: PB-242.EI
• Formula: C20 H30 N O8 P W
• Calculated formula: C20 H30 N O8 P W
• SMILES: [W]([P]1(ON2C(CCCC2(C)C)(C)C)OC(C(O1)(C)C)(C)C)(C#[O])(C#[O])(C#[O])(C#[O])C#[O]
• Title of publication: 1,3,2-Diheterophospholane complexes: access to new tuneable precursors of phosphanoxyl complexes and P-functional polymers
• Authors of publication: Brehm, Philipp; Müller-Feyen , Anne Sophie; Schnakenburg, Gregor; Streubel, R.
• Journal of publication: Dalton Transactions
• Year of publication: 2022
• a: 11.104 ± 0.0002 Å
• b: 14.0762 ± 0.0002 Å
• c: 15.5766 ± 0.0003 Å
• α: 90°
• β: 93.904 ± 0.002°
• γ: 90°
• Cell volume: 2429.01 ± 0.07 ų
• Cell temperature: 123 K
• Ambient diffraction temperature: 123 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.028
• Residual factor for significantly intense reflections: 0.0243
• Weighted residual factors for significantly intense reflections: 0.0598
• Weighted residual factors for all reflections included in the refinement: 0.0611
• Goodness-of-fit parameter for all reflections included in the refinement: 1.043
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No