Information card for entry 4301458

Structure parameters

• Formula: C21 H42 Er3 N4 O35 P2
• Calculated formula: C21 H27 Er3 N4 O35 P2
• Title of publication: Synthesis, Characterization, and Properties of Organically Templated Lanthanide Oxalatophosphates with a Three-Dimensional Honeycomb Structure: (H4APPIP)[Ln3(C2O4)5.5(H2PO4)2].5H2O (Ln = Er-Lu, APPIP = 1,4-Bis(3-aminopropyl)piperazine)
• Authors of publication: Chih-Min Wang; Yi-Ying Wu; Chia-Hung Hou; Chii-Chang Chen; Kwang-Hwa Lii
• Journal of publication: Inorganic Chemistry
• Year of publication: 2009
• Journal volume: 48
• Pages of publication: 1519 - 1523
• a: 8.5146 ± 0.0002 Å
• b: 16.2049 ± 0.0005 Å
• c: 28.547 ± 0.0008 Å
• α: 90°
• β: 96.212 ± 0.002°
• γ: 90°
• Cell volume: 3915.74 ± 0.19 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• 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: 0.0492
• Residual factor for significantly intense reflections: 0.0327
• Weighted residual factors for significantly intense reflections: 0.0729
• Weighted residual factors for all reflections included in the refinement: 0.0792
• Goodness-of-fit parameter for all reflections included in the refinement: 1.048
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No