Information card for entry 4122275

Structure parameters

• Formula: C44 H33 Cd3 N O12
• Calculated formula: C44 H33 Cd3 N O12
• Title of publication: Atomic structures and gram scale synthesis of three tetrahedral quantum dots.
• Authors of publication: Beecher, Alexander N.; Yang, Xiaohao; Palmer, Joshua H.; LaGrassa, Alexandra L.; Juhas, Pavol; Billinge, Simon J. L.; Owen, Jonathan S.
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2014
• Journal volume: 136
• Journal issue: 30
• Pages of publication: 10645 - 10653
• a: 17.0374 ± 0.0012 Å
• b: 9.1839 ± 0.0006 Å
• c: 26.2103 ± 0.0018 Å
• α: 90°
• β: 95.077 ± 0.001°
• γ: 90°
• Cell volume: 4085 ± 0.5 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0421
• Residual factor for significantly intense reflections: 0.0292
• Weighted residual factors for significantly intense reflections: 0.0562
• Weighted residual factors for all reflections included in the refinement: 0.0606
• Goodness-of-fit parameter for all reflections included in the refinement: 1.048
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No