Information card for entry 1568441

Structure parameters

• Formula: C31 H37 O P
• Calculated formula: C31 H37 O P
• Title of publication: Photochemical formation and reversible base-induced cleavage of a phosphagallene.
• Authors of publication: Taeufer, T.; Dankert, F.; Michalik, D.; Pospech, J.; Bresien, J.; Hering-Junghans, C
• Journal of publication: Chemical science
• Year of publication: 2023
• Journal volume: 14
• Journal issue: 11
• Pages of publication: 3018 - 3023
• a: 11.9426 ± 0.001 Å
• b: 18.1472 ± 0.0016 Å
• c: 12.6846 ± 0.001 Å
• α: 90°
• β: 98.094 ± 0.003°
• γ: 90°
• Cell volume: 2721.7 ± 0.4 ų
• Cell temperature: 110 ± 2 K
• Ambient diffraction temperature: 110 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0357
• Residual factor for significantly intense reflections: 0.0342
• Weighted residual factors for significantly intense reflections: 0.0893
• Weighted residual factors for all reflections included in the refinement: 0.0908
• Goodness-of-fit parameter for all reflections included in the refinement: 1.039
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No