Information card for entry 7709459

Structure parameters

• Chemical name: PB-211
• Formula: C19 H29 N2 O7 P W
• Calculated formula: C19 H29 N2 O7 P W
• SMILES: [W]([P]1(OCCN1C(C)C)ON1C(CCCC1(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: 8.2932 ± 0.0003 Å
• b: 10.1104 ± 0.0003 Å
• c: 15.3182 ± 0.0005 Å
• α: 73.319 ± 0.002°
• β: 74.659 ± 0.003°
• γ: 71.74 ± 0.003°
• Cell volume: 1146.66 ± 0.07 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0197
• Residual factor for significantly intense reflections: 0.0175
• Weighted residual factors for significantly intense reflections: 0.0418
• Weighted residual factors for all reflections included in the refinement: 0.0423
• Goodness-of-fit parameter for all reflections included in the refinement: 1.018
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No