Information card for entry 7239136

Structure parameters

• Formula: C88 H128 O16
• Calculated formula: C88 H128 O16
• Title of publication: Undecenyl resorc[4]arene in the chair conformation as preorganized synthon for olefin metathesis
• Authors of publication: Ghirga, Francesca; D'Acquarica, Ilaria; Monache, Giuliano Delle; Toscano, Sara; Mannina, Luisa; Sobolev, Anatoly P.; Ugozzoli, Franco; Crocco, Domenico; Antiochia, Riccarda; Botta, Bruno
• Journal of publication: RSC Advances
• Year of publication: 2013
• Journal volume: 3
• Journal issue: 38
• Pages of publication: 17567
• a: 12.297 ± 0.005 Å
• b: 17.946 ± 0.005 Å
• c: 10.559 ± 0.005 Å
• α: 100.61 ± 0.005°
• β: 102.44 ± 0.005°
• γ: 105.11 ± 0.005°
• Cell volume: 2124.3 ± 1.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 3
• Space group number: 1
• Hermann-Mauguin space group symbol: P 1
• Hall space group symbol: P 1
• Residual factor for all reflections: 0.134
• Residual factor for significantly intense reflections: 0.0639
• Weighted residual factors for significantly intense reflections: 0.143
• Weighted residual factors for all reflections included in the refinement: 0.1667
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No