Information card for entry 7028377

Structure parameters

• Formula: C6 H16 N O13 P2 Sm
• Calculated formula: C6 H16 N O13 P2 Sm
• Title of publication: Lanthanide(III) oxalatophosphonates: syntheses, crystal structures and luminescence properties.
• Authors of publication: Jiao, Cheng-Qi; Zhang, Ji-Cai; Zhao, Yan; Sun, Zhen-Gang; Zhu, Yan-Yu; Dai, Lu-Lu; Shi, Shao-Ping; Zhou, Wei
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2014
• Journal volume: 43
• Journal issue: 4
• Pages of publication: 1542 - 1549
• a: 12.7908 ± 0.0013 Å
• b: 8.9552 ± 0.0009 Å
• c: 14.5187 ± 0.0015 Å
• α: 90°
• β: 113.486 ± 0.001°
• γ: 90°
• Cell volume: 1525.3 ± 0.3 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 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: 0.032
• Residual factor for significantly intense reflections: 0.0244
• Weighted residual factors for significantly intense reflections: 0.0567
• Weighted residual factors for all reflections included in the refinement: 0.0605
• 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