Information card for entry 4109903

Structure parameters

• Formula: C96 H81 F9 N9 Nd O15 S3
• Calculated formula: C96 H81 F9 N9 Nd O15 S3
• Title of publication: Self-Assembly of Chiral Luminescent Lanthanide Coordination Bundles
• Authors of publication: Joseph P. Leonard; Paul Jensen; Thomas McCabe; John E. O'Brien; Robert D. Peacock; Paul E. Kruger; Thorfinnur Gunnlaugsson
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2007
• Journal volume: 129
• Pages of publication: 10986 - 10987
• a: 23.098 ± 0.002 Å
• b: 23.098 ± 0.002 Å
• c: 12.99 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 6001.9 ± 1.2 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 7
• Space group number: 182
• Hermann-Mauguin space group symbol: P 63 2 2
• Hall space group symbol: P 6c 2c
• Residual factor for all reflections: 0.0521
• Residual factor for significantly intense reflections: 0.0445
• Weighted residual factors for significantly intense reflections: 0.1179
• Weighted residual factors for all reflections included in the refinement: 0.1231
• Goodness-of-fit parameter for all reflections included in the refinement: 1.084
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No