Information card for entry 7027903

Structure parameters

• Formula: C38 H48 Cl3 N10 Nd O12
• Calculated formula: C38 H48 Cl3 N10 Nd O12
• Title of publication: Synthesis and crystal structural characterization of an unsymmetric neodymium(III) cryptate
• Authors of publication: Feng, Chang-Jian; Luo, Qin-Hui; Duan, Chun-Ying; Shen, Meng-Chang; Liu, Yong-Jiang
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 1998
• Journal issue: 8
• Pages of publication: 1377
• a: 17.139 ± 0.004 Å
• b: 20.84 ± 0.004 Å
• c: 24.965 ± 0.005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 8917 ± 3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.2695
• Residual factor for significantly intense reflections: 0.0768
• Weighted residual factors for all reflections: 0.2248
• Weighted residual factors for significantly intense reflections: 0.137
• Goodness-of-fit parameter for all reflections: 0.945
• Goodness-of-fit parameter for significantly intense reflections: 1.391
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No