Information card for entry 4516556

Structure parameters

• Formula: C122 H93 Gd3 N8 O45
• Calculated formula: C122 H77 Gd3 N8 O45
• Title of publication: Homochiral, Helical Coordination Complexes of Lanthanides(III) and Mixed-Metal Lanthanides(III): Impact of the 1,8-Naphthalimide Supramolecular Tecton on Structure, Magnetic Properties, and Luminescence
• Authors of publication: Reger, Daniel L.; Leitner, Andrew; Smith, Mark D.
• Journal of publication: Crystal Growth & Design
• Year of publication: 2015
• Journal volume: 15
• Journal issue: 11
• Pages of publication: 5637
• a: 14.9247 ± 0.0008 Å
• b: 14.9247 ± 0.0008 Å
• c: 55.654 ± 0.006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 12396.7 ± 1.6 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 96
• Hermann-Mauguin space group symbol: P 43 21 2
• Hall space group symbol: P 4nw 2abw
• Residual factor for all reflections: 0.0439
• Residual factor for significantly intense reflections: 0.0424
• Weighted residual factors for significantly intense reflections: 0.0938
• Weighted residual factors for all reflections included in the refinement: 0.0944
• Goodness-of-fit parameter for all reflections included in the refinement: 1.19
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No