Information card for entry 7206963

Structure parameters

• Formula: C9 H8 La N O8
• Calculated formula: C9 H8 La N O8
• Title of publication: Lanthanide-pyridyl-2,5-dicarboxylate N-oxide frameworks with rutile topology
• Authors of publication: Sun, Hao-Ling; Wang, Xiang-Li; Jia, Li; Cao, Wei; Wang, Ke-Zhi; Du, Miao
• Journal of publication: CrystEngComm
• Year of publication: 2012
• Journal volume: 14
• Journal issue: 2
• Pages of publication: 512
• a: 9.9138 ± 0.0001 Å
• b: 14.9969 ± 0.0002 Å
• c: 8.5545 ± 0.0001 Å
• α: 90°
• β: 98.582 ± 0.001°
• γ: 90°
• Cell volume: 1257.61 ± 0.03 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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: 0.0294
• Residual factor for significantly intense reflections: 0.0247
• Weighted residual factors for significantly intense reflections: 0.0563
• Weighted residual factors for all reflections included in the refinement: 0.0586
• Goodness-of-fit parameter for all reflections included in the refinement: 1.052
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No