Information card for entry 7050280

Structure parameters

• Common name: (Zn(IIMB)2)4(NO3)8-13.5(H2O)
• Chemical name: [Zn(IIMB)2]4(NO3)8-13.5(H2O)
• Formula: C104 H123 N40 O37.5 Zn4
• Calculated formula: C20 H17 N40 O37.466 Zn4
• Title of publication: Syntheses and Crystal Structures of 1D Tabular Chain and 2D Polycatenane Built from Asymmetric 1-(1-Imidazolyl)-4-(imidazol-1-ylmethyl)benzene Ligand with Metal Salts
• Authors of publication: Sun Wei-Yin; Jian Fan; Taka-aki Okamura; Norikazu Ueyama; Wei Zhao; Hui-Fang Zhu
• Journal of publication: New J.Chem.(Nouv.J.Chim.)
• Year of publication: 2004
• a: 14.8166 ± 0.0003 Å
• b: 18.2768 ± 0.0004 Å
• c: 24.8929 ± 0.0006 Å
• α: 69.9171 ± 0.0005°
• β: 75.1473 ± 0.0007°
• γ: 88.2844 ± 0.0009°
• Cell volume: 6107.1 ± 0.2 ų
• Cell temperature: 200 K
• Ambient diffraction temperature: 200 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1777
• Residual factor for significantly intense reflections: 0.1005
• Weighted residual factors for significantly intense reflections: 0.2823
• Weighted residual factors for all reflections included in the refinement: 0.3211
• Goodness-of-fit parameter for all reflections included in the refinement: 1.054
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No