Information card for entry 7060930

Structure parameters

• Formula: C52 H40 Co N4 O4 P2 S0
• Calculated formula: C52 H40 Co N4 O4 P2
• Title of publication: Magnetic anisotropies and slow magnetic relaxation of three tetrahedral tetrakis(pseudohalido)–cobalt(ii) complexes
• Authors of publication: Chen, Shu-Yang; Lv, Wei; Cui, Hui-Hui; Chen, Lei; Zhang, Yi-Quan; Chen, Xue-Tai; Wang, Zhenxing; Ouyang, Zhong-Wen; Yan, Hong; Xue, Zi-Ling
• Journal of publication: New Journal of Chemistry
• Year of publication: 2021
• Journal volume: 45
• Journal issue: 36
• Pages of publication: 16852 - 16861
• a: 22.276 ± 0.003 Å
• b: 14.828 ± 0.003 Å
• c: 13.6901 ± 0.0018 Å
• α: 90°
• β: 104.641 ± 0.004°
• γ: 90°
• Cell volume: 4375.1 ± 1.2 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 7
• 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: 0.0757
• Residual factor for significantly intense reflections: 0.057
• Weighted residual factors for significantly intense reflections: 0.1204
• Weighted residual factors for all reflections included in the refinement: 0.1269
• Goodness-of-fit parameter for all reflections included in the refinement: 1.098
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No