Information card for entry 7133527

Structure parameters

• Formula: C32 H28 O2
• Calculated formula: C32 H28 O2
• Title of publication: HFIP promoted carbo-lactonisation as a new route to functionalised lactones.
• Authors of publication: Aynetdinova, Daniya; Jaschinski, Megan; Jenkins, Timothy C.; Donohoe, Timothy J.
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2024
• Journal volume: 60
• Journal issue: 73
• Pages of publication: 9997 - 10000
• a: 5.9846 ± 0.0003 Å
• b: 8.734 ± 0.0004 Å
• c: 23.1074 ± 0.001 Å
• α: 94.785 ± 0.004°
• β: 93.664 ± 0.004°
• γ: 93.898 ± 0.004°
• Cell volume: 1197.87 ± 0.1 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 3
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0657
• Residual factor for significantly intense reflections: 0.049
• Weighted residual factors for all reflections: 0.1314
• Weighted residual factors for significantly intense reflections: 0.1215
• Weighted residual factors for all reflections included in the refinement: 0.1314
• Goodness-of-fit parameter for all reflections included in the refinement: 1.0254
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No