Information card for entry 1504841

Structure parameters

• Formula: C29.25 H31 N2 O2.25 P
• Calculated formula: C29.25 H31 N2 O2.25 P
• Title of publication: Dearomatizing anionic cyclization of phosphonamides. A route to phosphonic acid derivatives with antitumor properties.
• Authors of publication: Ruiz-Gómez, Gloria; Francesch, Andrés; Iglesias, María José; López-Ortiz, Fernando; Cuevas, Carmen; Serrano-Ruiz, Manuel
• Journal of publication: Organic letters
• Year of publication: 2008
• Journal volume: 10
• Journal issue: 18
• Pages of publication: 3981 - 3984
• a: 11.6003 ± 0.0012 Å
• b: 13.1387 ± 0.0013 Å
• c: 19.295 ± 0.002 Å
• α: 107.273 ± 0.003°
• β: 93.096 ± 0.003°
• γ: 109.039 ± 0.003°
• Cell volume: 2617.2 ± 0.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.12
• Residual factor for significantly intense reflections: 0.0705
• Weighted residual factors for significantly intense reflections: 0.1716
• Weighted residual factors for all reflections included in the refinement: 0.2025
• Goodness-of-fit parameter for all reflections included in the refinement: 1.013
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No