Information card for entry 4029780

Structure parameters

• Formula: C26 H20 O8
• Calculated formula: C26 H20 O8
• Title of publication: Formation of macrocyclic lactones in the Paternò-Büchi dimerization reaction.
• Authors of publication: Arimura, Junya; Mizuta, Tsutomu; Hiraga, Yoshikazu; Abe, Manabu
• Journal of publication: Beilstein journal of organic chemistry
• Year of publication: 2011
• Journal volume: 7
• Pages of publication: 265 - 269
• a: 9.2883 ± 0.0009 Å
• b: 11.2794 ± 0.0011 Å
• c: 11.673 ± 0.0012 Å
• α: 62.356 ± 0.001°
• β: 89.008 ± 0.001°
• γ: 89.893 ± 0.001°
• Cell volume: 1083.15 ± 0.19 ų
• Cell temperature: 173 K
• Ambient diffraction temperature: 173 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: 0.0389
• Residual factor for significantly intense reflections: 0.0356
• Weighted residual factors for significantly intense reflections: 0.1021
• Weighted residual factors for all reflections included in the refinement: 0.106
• Goodness-of-fit parameter for all reflections included in the refinement: 0.984
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No