Information card for entry 4309224

Structure parameters

• Formula: C108 H144 Cd3 Hg7 P4 Se16
• Calculated formula: C108 H60 Cd4.2 Hg5.8 P4 Se16
• Title of publication: Controlled Synthesis of Ternary II-II'-VI Nanoclusters and the Effects of Metal Ion Distribution on Their Spectral Properties
• Authors of publication: Marty W. DeGroot; Nicholas J. Taylor; John F. Corrigan
• Journal of publication: Inorganic Chemistry
• Year of publication: 2005
• Journal volume: 44
• Pages of publication: 5447 - 5458
• a: 18.6251 ± 0.0005 Å
• b: 18.6251 ± 0.0005 Å
• c: 18.6251 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 6460.9 ± 0.3 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 6
• Space group number: 217
• Hermann-Mauguin space group symbol: I -4 3 m
• Hall space group symbol: I -4 2 3
• Residual factor for all reflections: 0.063
• Residual factor for significantly intense reflections: 0.0412
• Weighted residual factors for significantly intense reflections: 0.1111
• Weighted residual factors for all reflections included in the refinement: 0.1244
• Goodness-of-fit parameter for all reflections included in the refinement: 1.018
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No