Information card for entry 4311479

Structure parameters

• Formula: C22 H39 N3 Na Nd O12
• Calculated formula: C22 H39 N3 Na Nd O12
• SMILES: [Nd]1234567(ON(=[O]1)=O)(ON(=[O]2)=O)(ON(=[O]3)=O)([O]1CCCC1)[c]1([c]7([c]6([c]5([c]41C)C)C)C)C.[Na]([O]1CCCC1)[O]1CCCC1
• Title of publication: Utility of Anhydrous Neodymium Nitrate as a Precursor to Extended Organoneodymium Nitrate Networks
• Authors of publication: William J. Evans; Dimitrios G. Giarikos; Penny S. Workman; Joseph W. Ziller
• Journal of publication: Inorganic Chemistry
• Year of publication: 2004
• Journal volume: 43
• Pages of publication: 5754 - 5760
• a: 9.9493 ± 0.0006 Å
• b: 11.3426 ± 0.0007 Å
• c: 14.0833 ± 0.0008 Å
• α: 68.769 ± 0.001°
• β: 85.817 ± 0.001°
• γ: 84.939 ± 0.001°
• Cell volume: 1474.23 ± 0.15 ų
• Cell temperature: 163 ± 2 K
• Ambient diffraction temperature: 163 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0268
• Residual factor for significantly intense reflections: 0.024
• Weighted residual factors for significantly intense reflections: 0.0589
• Weighted residual factors for all reflections included in the refinement: 0.0607
• Goodness-of-fit parameter for all reflections included in the refinement: 1.073
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No