Information card for entry 7710458

Structure parameters

• Formula: C44 H44 Co2 N18 O8 S4
• Calculated formula: C44 H44 Co2 N18 O8 S4
• Title of publication: Field-induced slow magnetic relaxation behaviours in binuclear cobalt(II) metallocycles and exchange-coupled clusters.
• Authors of publication: Shao, Dong; Moorthy, Shruti; Zhou, Yue; Wu, Si-Tong; Zhu, Jing-Yan; Yang, Jiong; Wu, Dong-Qing; Tian, Zhengfang; Singh, Saurabh Kumar
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2022
• Journal volume: 51
• Journal issue: 24
• Pages of publication: 9357 - 9368
• a: 8.6076 ± 0.0007 Å
• b: 11.4314 ± 0.001 Å
• c: 14.1068 ± 0.0013 Å
• α: 111.16 ± 0.003°
• β: 92.134 ± 0.003°
• γ: 105.776 ± 0.003°
• Cell volume: 1231.46 ± 0.19 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0874
• Residual factor for significantly intense reflections: 0.051
• Weighted residual factors for significantly intense reflections: 0.0933
• Weighted residual factors for all reflections included in the refinement: 0.1061
• Goodness-of-fit parameter for all reflections included in the refinement: 1.009
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No