Information card for entry 7009381

Structure parameters

• Formula: C28 H70 Co2 Gd2 N4 O34
• Calculated formula: C28 H36 Co2 Gd2 N4 O34
• Title of publication: Synthesis and structure of an unprecedented heterometallic tetranuclear cluster [Gd2Co2(μ4-O)(μ-H2O)(CDTA)2(H2O)6]·10H2O (H4CDTA = trans-1,2-cyclohexanedinitrilotetraacetic acid)
• Authors of publication: Ma, Bao-Qing; Gao, Song; Bai, Ou; Sun, Hao-Ling; Xu, Guang-Xian
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 2000
• Journal issue: 7
• Pages of publication: 1003
• a: 24.94 ± 0.002 Å
• b: 9.7718 ± 0.0008 Å
• c: 10.1941 ± 0.0006 Å
• α: 90°
• β: 109.64 ± 0.005°
• γ: 90°
• Cell volume: 2339.9 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 5
• Hermann-Mauguin space group symbol: C 1 2 1
• Hall space group symbol: C 2y
• Residual factor for all reflections: 0.0808
• Residual factor for significantly intense reflections: 0.0712
• Weighted residual factors for significantly intense reflections: 0.1821
• Weighted residual factors for all reflections included in the refinement: 0.1932
• Goodness-of-fit parameter for all reflections included in the refinement: 1.173
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No