Information card for entry 7223401

Structure parameters

• Formula: C73 H64 O7
• Calculated formula: C73 H63.9996 O7
• Title of publication: One-Pot C-C/C-O Bonds Formation: Synthesis of Spirocyclic Lactones
• Authors of publication: Gedu, Satyanarayana; Pedireddi, Niharika
• Journal of publication: RSC Adv.
• Year of publication: 2015
• a: 31.5874 ± 0.0013 Å
• b: 31.5874 ± 0.0013 Å
• c: 9.9815 ± 0.0003 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 8624.9 ± 0.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 3
• Space group number: 148
• Hermann-Mauguin space group symbol: R -3 :H
• Hall space group symbol: -R 3
• Residual factor for all reflections: 0.0876
• Residual factor for significantly intense reflections: 0.0679
• Weighted residual factors for significantly intense reflections: 0.2036
• Weighted residual factors for all reflections included in the refinement: 0.2309
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No