Information card for entry 7009717

Structure parameters

• Chemical name: catena-bis(tris(2-Amineoethyl)amine-cadmium(ii)) hexacyano-iron(ii) trihydrate
• Formula: C99 Cd11 Fe10.5 N77 O33
• Calculated formula: C18 Cd2 Fe N14 O6
• Title of publication: A novel μ3-cyano-bridged heterotrimetallic 2-D coordination polymer constructed from rectangular grids
• Authors of publication: Zhang, Hao; Cai, Jiwen; Feng, Xiao-Long; Ye, Bao-Hui; Li, Xiao-Yuan; Ji, Liang-Nian
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 2000
• Journal issue: 11
• Pages of publication: 1687
• a: 7.5219 ± 0.0019 Å
• b: 28.593 ± 0.007 Å
• c: 7.7246 ± 0.0019 Å
• α: 90°
• β: 106.345 ± 0.004°
• γ: 90°
• Cell volume: 1594.2 ± 0.7 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: 0.0441
• Residual factor for significantly intense reflections: 0.0425
• Weighted residual factors for significantly intense reflections: 0.1085
• Weighted residual factors for all reflections included in the refinement: 0.1093
• Goodness-of-fit parameter for all reflections included in the refinement: 1.18
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No