Information card for entry 7038531

Structure parameters

• Formula: C32 H43 K O6.5 S Si
• Calculated formula: C30 H39 K O6 S Si
• SMILES: [K]12345(S[Si](c6ccccc6)(c6ccccc6)c6ccccc6)[O]6CC[O]1CC[O]2CC[O]3CC[O]4CC[O]5CC6
• Title of publication: Synthesis and characterization of potassium aryl- and alkyl-substituted silylchalcogenolate ligands.
• Authors of publication: Brown, Jessie L.; Montgomery, Ashley C.; Samaan, Christopher A.; Janicke, Michael T.; Scott, Brian L.; Gaunt, Andrew J.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2016
• Journal volume: 45
• Journal issue: 24
• Pages of publication: 9841 - 9852
• a: 9.188 ± 0.008 Å
• b: 10.473 ± 0.009 Å
• c: 17.685 ± 0.014 Å
• α: 95.93 ± 0.009°
• β: 93.438 ± 0.009°
• γ: 94.815 ± 0.009°
• Cell volume: 1683 ± 2 ų
• Cell temperature: 140 ± 1 K
• Ambient diffraction temperature: 140 ± 1 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: 0.1072
• Residual factor for significantly intense reflections: 0.0564
• Weighted residual factors for significantly intense reflections: 0.1339
• Weighted residual factors for all reflections included in the refinement: 0.1594
• Goodness-of-fit parameter for all reflections included in the refinement: 0.781
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No