Information card for entry 4347684

Structure parameters

• Formula: C75 H84 B2 Ce Cl2 Co2 F30 N2 O22 P6
• Calculated formula: C75 H82 B2 Ce Cl2 Co2 F30 N2 O22 P6
• Title of publication: Probing the Reactivity of the Ce═O Multiple Bond in a Cerium(IV) Oxo Complex.
• Authors of publication: So, Yat-Ming; Li, Yang; Au-Yeung, Ka-Chun; Wang, Guo-Cang; Wong, Kang-Long; Sung, Herman H. Y.; Arnold, Polly L.; Williams, Ian D.; Lin, Zhenyang; Leung, Wa-Hung
• Journal of publication: Inorganic chemistry
• Year of publication: 2016
• Journal volume: 55
• Journal issue: 20
• Pages of publication: 10003 - 10012
• a: 25.9526 ± 0.0003 Å
• b: 15.35706 ± 0.00017 Å
• c: 24.5163 ± 0.0003 Å
• α: 90°
• β: 92.1748 ± 0.0011°
• γ: 90°
• Cell volume: 9764.1 ± 0.2 ų
• Cell temperature: 173 ± 0.1 K
• Ambient diffraction temperature: 173 ± 0.1 K
• Number of distinct elements: 10
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0537
• Residual factor for significantly intense reflections: 0.0403
• Weighted residual factors for significantly intense reflections: 0.0943
• Weighted residual factors for all reflections included in the refinement: 0.1008
• Goodness-of-fit parameter for all reflections included in the refinement: 1.002
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No