Information card for entry 7000685

Structure parameters

• Formula: C12 H12 N2 O16 Yb2
• Calculated formula: C12 H12 N2 O16 Yb2
• Title of publication: In situ cyclodehydration of iminodiacetic acid into 2,5-diketopiperazine-1,4-diacetate in lanthanide-based coordination polymers
• Authors of publication: Kong, Xiang-Jian; Zhuang, Gui-Lin; Ren, Yan-Ping; Long, La-Sheng; Huang, Rong-Bin; Zheng, Lan-Sun
• Journal of publication: Dalton Transactions
• Year of publication: 2009
• Journal issue: 10
• Pages of publication: 1707 - 1709
• a: 6.6649 ± 0.0015 Å
• b: 7.7808 ± 0.0017 Å
• c: 9.076 ± 0.002 Å
• α: 95.798 ± 0.003°
• β: 109.928 ± 0.003°
• γ: 93.594 ± 0.003°
• Cell volume: 437.84 ± 0.17 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 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: 0.0207
• Residual factor for significantly intense reflections: 0.0206
• Weighted residual factors for significantly intense reflections: 0.0538
• Weighted residual factors for all reflections included in the refinement: 0.0539
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No