Information card for entry 4310781

Structure parameters

• Formula: C21 H15 N3 Nd2 O15
• Calculated formula: C21 H9 N3 Nd2 O15
• Title of publication: Self-Assembly of Lanthanide Helicate Coordination Polymers into 3D Metal-Organic Framework Structures
• Authors of publication: Sujit K. Ghosh; Parimal K. Bharadwaj
• Journal of publication: Inorganic Chemistry
• Year of publication: 2004
• Journal volume: 43
• Pages of publication: 2293 - 2298
• a: 10.944 ± 0.003 Å
• b: 17.448 ± 0.005 Å
• c: 13.397 ± 0.002 Å
• α: 90°
• β: 101.19 ± 0.03°
• γ: 90°
• Cell volume: 2509.5 ± 1.1 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/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1125
• Residual factor for significantly intense reflections: 0.0846
• Weighted residual factors for significantly intense reflections: 0.2676
• Weighted residual factors for all reflections included in the refinement: 0.2972
• Goodness-of-fit parameter for all reflections included in the refinement: 1.323
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No