Information card for entry 4312610

Structure parameters

• Formula: C36 H48.25 I3 Lu N7.75 O3
• Calculated formula: C36 H44.75 I3 Lu N7.75 O3
• Title of publication: Solid-State and Solution Properties of Cationic Lanthanide Complexes of a New Neutral Heptadentate N4O3 Tripodal Ligand
• Authors of publication: Florence Bravard; Yann Bretonnière; Raphaël Wietzke; Christelle Gateau; Marinella Mazzanti; Pascale Delangle; Jacques Pécaut
• Journal of publication: Inorganic Chemistry
• Year of publication: 2003
• Journal volume: 42
• Pages of publication: 7978 - 7989
• a: 24.456 ± 0.001 Å
• b: 14.1768 ± 0.0006 Å
• c: 26.0027 ± 0.0011 Å
• α: 90°
• β: 101.618 ± 0.001°
• γ: 90°
• Cell volume: 8830.6 ± 0.6 ų
• Cell temperature: 223 ± 2 K
• Ambient diffraction temperature: 223 ± 2 K
• Number of distinct elements: 6
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/n 1
• Hall space group symbol: -P 2yac
• Residual factor for all reflections: 0.0675
• Residual factor for significantly intense reflections: 0.0371
• Weighted residual factors for significantly intense reflections: 0.1029
• Weighted residual factors for all reflections included in the refinement: 0.1096
• Goodness-of-fit parameter for all reflections included in the refinement: 1.076
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No