Information card for entry 4314967

Structure parameters

• Common name: [LZn3(OAc)2(MeOH)2](CHCl3)(MeOH)0.5
• Formula: C39.5 H47 Cl3 N4 O16.5 Zn3
• Calculated formula: C39.5 H47 Cl3 N4 O16.5 Zn3
• Title of publication: Modulation of Multimetal Complexation Behavior of Tetraoxime Ligand by Covalent Transformation of Olefinic Functionalities
• Authors of publication: Shigehisa Akine; Satoko Kagiyama; Tatsuya Nabeshima
• Journal of publication: Inorganic Chemistry
• Year of publication: 2010
• Journal volume: 49
• Pages of publication: 2141 - 2152
• a: 13.35 ± 0.006 Å
• b: 14.073 ± 0.004 Å
• c: 14.187 ± 0.004 Å
• α: 83.293 ± 0.012°
• β: 68.602 ± 0.015°
• γ: 70.833 ± 0.014°
• Cell volume: 2344.1 ± 1.4 ų
• Cell temperature: 120 K
• Ambient diffraction temperature: 120 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: 0.0559
• Residual factor for significantly intense reflections: 0.0504
• Weighted residual factors for significantly intense reflections: 0.1511
• Weighted residual factors for all reflections included in the refinement: 0.1551
• Goodness-of-fit parameter for all reflections included in the refinement: 1.043
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No