Information card for entry 2234758

Structure parameters

• Chemical name: Poly[[tri-μ~3~-hydroxido-tris(μ~4~-pyridine-2,5- dicarboxylato)trineodymium(III)] monohydrate]
• Formula: C21 H14 N3 Nd3 O16
• Calculated formula: C21 H12 N3 Nd3 O16
• Title of publication: Poly[[tri-μ~3~-hydroxido-tris(μ~4~-pyridine-2,5-dicarboxylato)trineodymium(III)] monohydrate]
• Authors of publication: Zhang, Qing; Wang, Xing; Wang, Shen-Tang; Liu, Chun-Bo; Che, Guang-Bo
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 5
• Pages of publication: m541 - m542
• a: 23.081 ± 0.003 Å
• b: 23.081 ± 0.003 Å
• c: 8.969 ± 0.0018 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 4137.9 ± 1.1 ų
• Cell temperature: 297 ± 2 K
• Ambient diffraction temperature: 297 ± 2 K
• Number of distinct elements: 5
• Space group number: 148
• Hermann-Mauguin space group symbol: R -3 :H
• Hall space group symbol: -R 3
• Residual factor for all reflections: 0.0216
• Residual factor for significantly intense reflections: 0.0188
• Weighted residual factors for significantly intense reflections: 0.0419
• Weighted residual factors for all reflections included in the refinement: 0.0425
• Goodness-of-fit parameter for all reflections included in the refinement: 1.104
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes