Information card for entry 7009458

Structure parameters

• Formula: C84 H74 Cl3 N20 Nd O13
• Calculated formula: C84 H66 Cl3 N20 Nd O13
• Title of publication: Doubly interpenetrating stereoisomeric three-dimensional frameworks of tripodal neodymium(III) complexes from potentially spacer-controlled enantioselective self-assembly
• Authors of publication: Su, Cheng-Yong; Kang, Bei-Sheng; Yang, Qing-Chuan; Mak, Thomas C. W.
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 2000
• Journal issue: 12
• Pages of publication: 1857
• a: 22.147 ± 0.004 Å
• b: 16.082 ± 0.003 Å
• c: 26.748 ± 0.005 Å
• α: 90°
• β: 113.66 ± 0.03°
• γ: 90°
• Cell volume: 8726 ± 3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0887
• Residual factor for significantly intense reflections: 0.0836
• Weighted residual factors for significantly intense reflections: 0.2338
• Weighted residual factors for all reflections included in the refinement: 0.2404
• Goodness-of-fit parameter for all reflections included in the refinement: 1.112
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No