Information card for entry 4130698

Structure parameters

• Formula: C65.34 H67.68 I6 N12 O4.82 Zn3
• Calculated formula: C65.348 H67.688 I6.0001 N12 O4.824 Zn3
• Title of publication: X-ray Structure Analysis of Ozonides by the Crystalline Sponge Method.
• Authors of publication: Yoshioka, Shota; Inokuma, Yasuhide; Duplan, Vincent; Dubey, Ritesh; Fujita, Makoto
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2016
• Journal volume: 138
• Journal issue: 32
• Pages of publication: 10140 - 10142
• a: 35.5334 ± 0.0009 Å
• b: 14.9227 ± 0.0003 Å
• c: 30.6034 ± 0.001 Å
• α: 90°
• β: 102.176 ± 0.003°
• γ: 90°
• Cell volume: 15862.5 ± 0.8 ų
• Cell temperature: 93 ± 2 K
• Ambient diffraction temperature: 93 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.066
• Residual factor for significantly intense reflections: 0.0621
• Weighted residual factors for significantly intense reflections: 0.1783
• Weighted residual factors for all reflections included in the refinement: 0.1845
• Goodness-of-fit parameter for all reflections included in the refinement: 1.027
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No