Information card for entry 4314371

Structure parameters

• Formula: C42 H39 La N6 O15
• Calculated formula: C42 H39 La N6 O15
• SMILES: [La]123(ON(=[O]1)=O)(ON(=[O]2)=O)(ON(=[O]3)=O)([O]=C1C(OC)=CC=CC1=CNc1ccccc1)([O]=C1C(OC)=CC=CC1=CNc1ccccc1)[O]=C1C(OC)=CC=CC1=CNc1ccccc1
• Title of publication: Structure-Based Description of a Step-by-Step Synthesis of Homo- and Heterodinuclear (4f, 4f') Lanthanide Complexes
• Authors of publication: Jean-Pierre Costes; Françoise Dahan; Franck Nicodème
• Journal of publication: Inorganic Chemistry
• Year of publication: 2003
• Journal volume: 42
• Pages of publication: 6556 - 6563
• a: 11.1883 ± 0.0007 Å
• b: 11.8993 ± 0.0009 Å
• c: 16.4197 ± 0.001 Å
• α: 81.9 ± 0.006°
• β: 79.406 ± 0.005°
• γ: 79.47 ± 0.006°
• Cell volume: 2099.5 ± 0.2 ų
• Cell temperature: 160 ± 2 K
• Ambient diffraction temperature: 160 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.033
• Residual factor for significantly intense reflections: 0.0289
• Weighted residual factors for significantly intense reflections: 0.0517
• Weighted residual factors for all reflections included in the refinement: 0.0529
• Goodness-of-fit parameter for all reflections included in the refinement: 1.002
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No