Information card for entry 7107948

Structure parameters

• Formula: C48 H100 Pb2 Si8 Te2
• Calculated formula: C48 H100 Pb2 Si8 Te2
• SMILES: C(C)(C)(C)[Si](C(C)(C)C)(c1ccccc1)[Te]1[Pb](C([Si](C)(C)C)([Si](C)(C)C)[Si](C)(C)C)[Te]([Pb]1C([Si](C)(C)C)([Si](C)(C)C)[Si](C)(C)C)[Si](C(C)(C)C)(C(C)(C)C)c1ccccc1
• Title of publication: Cyclic and polycyclic tellurium-tin and tellurium-lead compounds ‒ synthesis, structures and thermal decomposition
• Authors of publication: Stephan Traut; Carsten von Hanisch; Alexander Peter Hahnel; Sven Stahl
• Journal of publication: Chem.Commun.
• Year of publication: 2012
• Journal volume: 48
• Pages of publication: 6984
• a: 13.762 ± 0.006 Å
• b: 19.778 ± 0.007 Å
• c: 25.104 ± 0.013 Å
• α: 90°
• β: 103.36 ± 0.04°
• γ: 90°
• Cell volume: 6648 ± 5 ų
• Cell temperature: 180 ± 2 K
• Ambient diffraction temperature: 180 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.1312
• Residual factor for significantly intense reflections: 0.0689
• Weighted residual factors for significantly intense reflections: 0.1458
• Weighted residual factors for all reflections included in the refinement: 0.1732
• Goodness-of-fit parameter for all reflections included in the refinement: 0.953
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No