Information card for entry 7131246

Structure parameters

• Formula: C8 H24 Cl20 Si11 Sn4
• Calculated formula: C8.004 H24 Cl19.996 Si10.998 Sn4.002
• Title of publication: Group IV heteroadamantanes: synthesis of Si₆Sn₄ and site-selective derivatization of Si₆Ge₄.
• Authors of publication: Köstler, Benedikt; Gilmer, Jannik; Bolte, Michael; Virovets, Alexander; Lerner, Hans-Wolfram; Albert, Philipp; Fantuzzi, Felipe; Wagner, Matthias
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2023
• Journal volume: 59
• Journal issue: 16
• Pages of publication: 2295 - 2298
• a: 15.4337 ± 0.0003 Å
• b: 15.4337 ± 0.0003 Å
• c: 10.8282 ± 0.0004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2579.27 ± 0.12 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 119
• Hermann-Mauguin space group symbol: I -4 m 2
• Hall space group symbol: I -4 -2
• Residual factor for all reflections: 0.0314
• Residual factor for significantly intense reflections: 0.0301
• Weighted residual factors for significantly intense reflections: 0.0677
• Weighted residual factors for all reflections included in the refinement: 0.0684
• Goodness-of-fit parameter for all reflections included in the refinement: 1.187
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No