Information card for entry 4067357

Structure parameters

• Formula: C25 H21 Cl Ge P2 S2
• Calculated formula: C25 H21 Cl Ge P2 S2
• SMILES: [Ge]1(Cl)[S]=P(C1P(=S)(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1
• Title of publication: Synthesis, Structure, and Reactivity of Group 14 Bis(thiophosphinoyl) Metal Complexes
• Authors of publication: Leung, Wing-Por; Wan, Chi-Ling; Kan, Kwok-Wai; Mak, Thomas C. W.
• Journal of publication: Organometallics
• Year of publication: 2010
• Journal volume: 29
• Journal issue: 4
• Pages of publication: 814
• a: 16.213 ± 0.003 Å
• b: 8.9053 ± 0.0014 Å
• c: 18.961 ± 0.003 Å
• α: 90°
• β: 113.28 ± 0.003°
• γ: 90°
• Cell volume: 2514.7 ± 0.7 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• 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: 0.1579
• Residual factor for significantly intense reflections: 0.0639
• Weighted residual factors for significantly intense reflections: 0.1833
• Weighted residual factors for all reflections included in the refinement: 0.2348
• Goodness-of-fit parameter for all reflections included in the refinement: 1.079
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No