Information card for entry 4309350

Structure parameters

• Formula: C18 H26 Cd N2 S2
• Calculated formula: C18 H26 Cd N2 S2
• SMILES: [Cd]1(Sc2ccccc2)(Sc2ccccc2)[N](C)(C)CC[N]1(C)C
• Title of publication: Stabilization of the Thermodynamically Favored Polymorph of Cadmium Chalcogenide Nanoparticles CdX (X = S, Se, Te) in the Polar Mesopores of SBA-15 Silica
• Authors of publication: Maekele Yosef; Andreas K. Schaper; Michael Fröba; Sabine Schlecht
• Journal of publication: Inorganic Chemistry
• Year of publication: 2005
• Journal volume: 44
• Pages of publication: 5890 - 5896
• a: 13.0297 ± 0.001 Å
• b: 11.2005 ± 0.0011 Å
• c: 14.3847 ± 0.0011 Å
• α: 90°
• β: 114.023 ± 0.008°
• γ: 90°
• Cell volume: 1917.5 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0538
• Residual factor for significantly intense reflections: 0.0282
• Weighted residual factors for significantly intense reflections: 0.0492
• Weighted residual factors for all reflections included in the refinement: 0.0532
• Goodness-of-fit parameter for all reflections included in the refinement: 0.831
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No