Information card for entry 4103678

Structure parameters

• Formula: C42 H66 Cl3 Cu3 F6 N10 O6 P2
• Calculated formula: C42 H66 Cl3 Cu3 F6 N10 O6 P2
• Title of publication: Tripodal Tris-tacn and Tris-dpa Platforms for Assembling Phosphate-Templated Trimetallic Centers
• Authors of publication: Rui Cao; Peter Müller; Stephen J. Lippard
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2010
• Journal volume: 132
• Pages of publication: 17366 - 17369
• a: 15.2562 ± 0.0006 Å
• b: 15.2562 ± 0.0006 Å
• c: 40.444 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 8152.2 ± 0.8 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 8
• Space group number: 148
• Hermann-Mauguin space group symbol: R -3 :H
• Hall space group symbol: -R 3
• Residual factor for all reflections: 0.0481
• Residual factor for significantly intense reflections: 0.0406
• Weighted residual factors for significantly intense reflections: 0.108
• Weighted residual factors for all reflections included in the refinement: 0.1131
• Goodness-of-fit parameter for all reflections included in the refinement: 1.079
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No