Information card for entry 4311412

Structure parameters

• Formula: C26 H30 N10
• Calculated formula: C26 H30 N10
• SMILES: N(Cc1cnccn1)(Cc1nccnc1)[C@@H]1[C@@H](N(Cc2nccnc2)Cc2nccnc2)CCCC1
• Title of publication: Comparative Structural Studies of Iodide Complexes of Uranium(III) and Lanthanide(III) with Hexadentate Tetrapodal Neutral N-Donor Ligands
• Authors of publication: Lydia Karmazin; Marinella Mazzanti; Jean-Philippe Bezombes; Christelle Gateau; Jacques Pécaut
• Journal of publication: Inorganic Chemistry
• Year of publication: 2004
• Journal volume: 43
• Pages of publication: 5147 - 5158
• a: 22.9279 ± 0.0017 Å
• b: 8.3801 ± 0.0006 Å
• c: 12.929 ± 0.001 Å
• α: 90°
• β: 91.893 ± 0.001°
• γ: 90°
• Cell volume: 2482.8 ± 0.3 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 3
• Space group number: 5
• Hermann-Mauguin space group symbol: C 1 2 1
• Hall space group symbol: C 2y
• Residual factor for all reflections: 0.0928
• Residual factor for significantly intense reflections: 0.0466
• Weighted residual factors for significantly intense reflections: 0.1153
• Weighted residual factors for all reflections included in the refinement: 0.1361
• Goodness-of-fit parameter for all reflections included in the refinement: 0.885
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No