Information card for entry 4336162

Structure parameters

• Formula: C22 H18 Co1.5 N12 O12
• Calculated formula: C22 H18 Co1.5 N12 O12
• Title of publication: Tuning Transverse Anisotropy in CoIII-CoII-CoIII Mixed-Valence Complex toward Slow Magnetic Relaxation
• Authors of publication: Dayu Wu; Xingxing Zhang; Ping Huang; Wei Huang; Mingyue Ruan; Z. W. Ouyang
• Journal of publication: Inorganic Chemistry
• Year of publication: 2013
• Journal volume: 52
• Pages of publication: 10976 - 10982
• a: 8.9739 ± 0.0004 Å
• b: 10.1458 ± 0.0004 Å
• c: 16.9041 ± 0.0005 Å
• α: 85.65 ± 0.003°
• β: 84.829 ± 0.003°
• γ: 75.965 ± 0.004°
• Cell volume: 1484.73 ± 0.1 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 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: 0.069
• Residual factor for significantly intense reflections: 0.0638
• Weighted residual factors for significantly intense reflections: 0.1862
• Weighted residual factors for all reflections included in the refinement: 0.1906
• Goodness-of-fit parameter for all reflections included in the refinement: 1.06
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No