Information card for entry 4317644

Structure parameters

• Formula: C16 H29 N3 P S Si Tl
• Calculated formula: C16 H29 N3 P S Si Tl
• SMILES: [Tl]1[S]=P2(N(C(C)(C)C)[Si](N2C(C)(C)C)(C)C)N1c1ccccc1
• Title of publication: Syntheses and Structures of P-Anilino-P-chalcogeno- and P-Anilino-P-iminodiazasilaphosphetidines and Their Group 12 and 13 Metal Compounds
• Authors of publication: Dana C. Haagenson; Daniel F. Moser; Lothar Stahl; Richard J. Staples
• Journal of publication: Inorganic Chemistry
• Year of publication: 2002
• Journal volume: 41
• Pages of publication: 1245 - 1253
• a: 13.5033 ± 0.0007 Å
• b: 9.437 ± 0.0004 Å
• c: 17.6696 ± 0.0009 Å
• α: 90°
• β: 109.055 ± 0.001°
• γ: 90°
• Cell volume: 2128.27 ± 0.18 ų
• Cell temperature: 213 ± 2 K
• Ambient diffraction temperature: 213 ± 2 K
• Number of distinct elements: 7
• 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: 0.0287
• Residual factor for significantly intense reflections: 0.024
• Weighted residual factors for significantly intense reflections: 0.0615
• Weighted residual factors for all reflections included in the refinement: 0.0634
• Goodness-of-fit parameter for all reflections included in the refinement: 1.046
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No