Information card for entry 4036207

Structure parameters

• Formula: C19 H25 O4 P
• Calculated formula: C19 H25 O4 P
• Title of publication: H-adamantylphosphinates as universal precursors of P-stereogenic compounds.
• Authors of publication: Gatineau, David; Nguyen, Duc Hanh; Hérault, Damien; Vanthuyne, Nicolas; Leclaire, Julien; Giordano, Laurent; Buono, Gérard
• Journal of publication: The Journal of organic chemistry
• Year of publication: 2015
• Journal volume: 80
• Journal issue: 8
• Pages of publication: 4132 - 4141
• a: 6.6376 ± 0.0002 Å
• b: 9.3332 ± 0.0003 Å
• c: 29.571 ± 0.001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1831.92 ± 0.1 ų
• Cell temperature: 293 ± 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: 0.1735
• Residual factor for significantly intense reflections: 0.0531
• Weighted residual factors for significantly intense reflections: 0.1055
• Weighted residual factors for all reflections included in the refinement: 0.1326
• Goodness-of-fit parameter for all reflections included in the refinement: 0.886
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No