Information card for entry 7111257

Structure parameters

• Formula: C26 H37 O2 P
• Calculated formula: C26 H37 O2 P
• SMILES: P1(=O)([C@@H]2[C@H]3CC[C@@](C3(C)C)(C)[C@@H]2O[C@@H]2[C@]3(C)CC[C@@H](C3(C)C)[C@H]12)c1ccccc1
• Title of publication: Chiral pentacyclic phosphines as a new ligand class
• Authors of publication: Haigh, Robert; Malik, K. M. Abdul; Newman, Paul D.
• Journal of publication: Chemical Communications
• Year of publication: 2002
• Journal issue: 21
• Pages of publication: 2558 - 2559
• a: 11.656 ± 0.002 Å
• b: 12.06 ± 0.002 Å
• c: 16.579 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2330.5 ± 0.7 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• 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: 0.0422
• Residual factor for significantly intense reflections: 0.0365
• Weighted residual factors for significantly intense reflections: 0.0831
• Weighted residual factors for all reflections included in the refinement: 0.0858
• Goodness-of-fit parameter for all reflections included in the refinement: 1.035
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No