Information card for entry 1542338

Structure parameters

• Formula: C414 H324
• Calculated formula: C414 H324
• Title of publication: Building Giant Carbocycles by Reversible C-C Bond Formation
• Authors of publication: Daniel Beaudoin; Olivier Levasseur-Grenon; Thierry Maris; James D. Wuest
• Journal of publication: Angew. Chem. Int. Ed.
• Year of publication: 2016
• Journal volume: 55
• Pages of publication: 894 - 898
• a: 21.4238 ± 0.0013 Å
• b: 24.3862 ± 0.0015 Å
• c: 32.254 ± 0.002 Å
• α: 78.729 ± 0.003°
• β: 76.442 ± 0.003°
• γ: 69.579 ± 0.003°
• Cell volume: 15231.9 ± 1.7 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 2
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1514
• Residual factor for significantly intense reflections: 0.0896
• Weighted residual factors for significantly intense reflections: 0.2487
• Weighted residual factors for all reflections included in the refinement: 0.3004
• Goodness-of-fit parameter for all reflections included in the refinement: 1.031
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes