Information card for entry 7123131

Structure parameters

• Formula: C29 H24 O3 P V
• Calculated formula: C29 H24 O3 P V
• Title of publication: An untethered C3v-symmetric triarylphosphine oxide locked by intermolecular hydrogen bonding
• Authors of publication: Carroll, Timothy G.; Hunt, Camden; Garwick, Rachel; Wu, Guang; Dobrovetsky, Roman; Ménard, Gabriel
• Journal of publication: Chemical Communications
• Year of publication: 2019
• a: 10.19 ± 0.008 Å
• b: 11.081 ± 0.009 Å
• c: 21.34 ± 0.019 Å
• α: 90°
• β: 97.09 ± 0.06°
• γ: 90°
• Cell volume: 2391 ± 3 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 107.05 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1367
• Residual factor for significantly intense reflections: 0.0639
• Weighted residual factors for significantly intense reflections: 0.1699
• Weighted residual factors for all reflections included in the refinement: 0.228
• Goodness-of-fit parameter for all reflections included in the refinement: 0.8971
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No