Information card for entry 7703405

Structure parameters

• Formula: C33 H47 P S3 Si3 Sn
• Calculated formula: C33 H47 P S3 Si3 Sn
• Title of publication: Homoleptic trimethylsilylchalcogenolato zincates [Zn(ESiMe₃)₃]^- and stannanides [Sn(ESiMe₃)₃]^- (E = S, Se): precursors in solution-based low-temperature binary metal chalcogenide and Cu₂ZnSnS₄ (CZTS) synthesis.
• Authors of publication: Guschlbauer, Jannick; Vollgraff, Tobias; Sundermeyer, Jörg
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2020
• Journal volume: 49
• Journal issue: 8
• Pages of publication: 2517 - 2526
• a: 12.1418 ± 0.0007 Å
• b: 16.0663 ± 0.0009 Å
• c: 22.2417 ± 0.0013 Å
• α: 110.185 ± 0.002°
• β: 99.2 ± 0.002°
• γ: 94.62 ± 0.002°
• Cell volume: 3976.6 ± 0.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0386
• Residual factor for significantly intense reflections: 0.0304
• Weighted residual factors for significantly intense reflections: 0.0637
• Weighted residual factors for all reflections included in the refinement: 0.0669
• Goodness-of-fit parameter for all reflections included in the refinement: 1.075
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No