Information card for entry 4063992

Structure parameters

• Formula: C38 H62 Cl2 Ge2 N4 O2 S2
• Calculated formula: C38 H62 Cl2 Ge2 N4 O2 S2
• Title of publication: Synthesis and Structure of [{PhC(NtBu)2}2Ge2(μ-S)2Cl2] and a Germanium Dithiocarboxylate Analogue
• Authors of publication: Sen, Sakya S.; Ghadwal, Rajendra S.; Kratzert, Daniel; Stern, Daniel; Roesky, Herbert W.; Stalke, Dietmar
• Journal of publication: Organometallics
• Year of publication: 2011
• Journal volume: 30
• Journal issue: 5
• Pages of publication: 1030
• a: 8.8939 ± 0.0007 Å
• b: 16.7399 ± 0.0014 Å
• c: 14.4141 ± 0.0012 Å
• α: 90°
• β: 96.322 ± 0.001°
• γ: 90°
• Cell volume: 2133 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0183
• Residual factor for significantly intense reflections: 0.0177
• Weighted residual factors for significantly intense reflections: 0.047
• Weighted residual factors for all reflections included in the refinement: 0.0473
• 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: Yes
• Has Fobs: No