Information card for entry 4508636

Structure parameters

• Formula: C74 H98 Cd4 N12 O31
• Calculated formula: C74 H68 Cd4 N12 O31
• Title of publication: Anion Effect on the Structural Conformation of Tetranuclear Cadmium(II) Complexes
• Authors of publication: Wang, Ruihu; Yuan, Daqiang; Jiang, Feilong; Han, Lei; Gong, Yaqiong; Hong, Maochun
• Journal of publication: Crystal Growth & Design
• Year of publication: 2006
• Journal volume: 6
• Journal issue: 6
• Pages of publication: 1351
• a: 20.9727 ± 0.0004 Å
• b: 19.1255 ± 0.0002 Å
• c: 21.2366 ± 0.0003 Å
• α: 90°
• β: 90.802 ± 0.001°
• γ: 90°
• Cell volume: 8517.4 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.1021
• Residual factor for significantly intense reflections: 0.0608
• Weighted residual factors for significantly intense reflections: 0.1377
• Weighted residual factors for all reflections included in the refinement: 0.1702
• Goodness-of-fit parameter for all reflections included in the refinement: 1.131
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No