Information card for entry 7061754

Structure parameters

• Formula: C184 H164 Co6 N66 O29
• Calculated formula: C184 H164 Co6 N66 O29
• Title of publication: Slow magnetic relaxation and spin crossover behavior in two mixed-valence Co(ii)/Co(iii) complexes
• Authors of publication: Huang, You-Lin; Zhong, Yun-Jing; Ye, Hua-Jian; Li, You-Hong; Kuang, Xiao-Man; Ouyang, Zhi-Jian; Chen, Wen-Bin; Yang, Meng; Dong, Wen
• Journal of publication: New Journal of Chemistry
• Year of publication: 2022
• Journal volume: 46
• Journal issue: 37
• Pages of publication: 17720 - 17725
• a: 16.2176 ± 0.0004 Å
• b: 17.026 ± 0.0003 Å
• c: 17.2151 ± 0.0003 Å
• α: 82.777 ± 0.002°
• β: 75.137 ± 0.002°
• γ: 83.919 ± 0.002°
• Cell volume: 4544.47 ± 0.17 ų
• Cell temperature: 213.99 ± 0.11 K
• Ambient diffraction temperature: 213.99 ± 0.11 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0973
• Residual factor for significantly intense reflections: 0.0759
• Weighted residual factors for significantly intense reflections: 0.2015
• Weighted residual factors for all reflections included in the refinement: 0.2247
• Goodness-of-fit parameter for all reflections included in the refinement: 1.05
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No