Information card for entry 4332448

Structure parameters

• Formula: C17 H27 N3 O3
• Calculated formula: C17 H27 N3 O3
• SMILES: O=n1c(cccc1CC(=O)NC(C)(C)C)CC(=O)NC(C)(C)C
• Title of publication: Synthesis and Lanthanide Coordination Properties of New 2,6-Bis(N-tert-butylacetamide)pyridine and 2,6-Bis(N-tert-butylacetamide)pyridine-N-oxide Ligands
• Authors of publication: Binyamin, Iris; Pailloux, Sylvie; Duesler, Eileen N.; Rapko, Brian M.; Paine, Robert T.
• Journal of publication: Inorganic Chemistry
• Year of publication: 2006
• Journal volume: 45
• Journal issue: 15
• Pages of publication: 5886 - 5892
• a: 7.0703 ± 0.0006 Å
• b: 9.373 ± 0.001 Å
• c: 14.355 ± 0.003 Å
• α: 94.016 ± 0.013°
• β: 102.593 ± 0.011°
• γ: 90.14 ± 0.009°
• Cell volume: 926 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0552
• Residual factor for significantly intense reflections: 0.0425
• Weighted residual factors for significantly intense reflections: 0.1076
• Weighted residual factors for all reflections included in the refinement: 0.1154
• Goodness-of-fit parameter for all reflections included in the refinement: 1.036
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No