Information card for entry 7113227

Structure parameters

• Formula: C15 H22 Cl2 O6
• Calculated formula: C15 H22 Cl2 O6
• SMILES: Cl[C@]12C(=O)[C@]3(OC[C@H](OC)C3)[C@](Cl)(C1(OC)OC)C[C@H]2OCC.Cl[C@@]12C(=O)[C@@]3(OC[C@@H](OC)C3)[C@@](Cl)(C1(OC)OC)C[C@@H]2OCC
• Title of publication: Lead(IV) acetate: intriguing reactivity profile
• Authors of publication: Khan, Faiz Ahmed; Sudheer, Ch.; Soma, Laxminarayana
• Journal of publication: Chemical Communications (Cambridge, United Kingdom)
• Year of publication: 2007
• Journal issue: 41
• Pages of publication: 4239 - 4241
• a: 34.375 ± 0.002 Å
• b: 34.375 ± 0.002 Å
• c: 7.2354 ± 0.0006 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 7404.2 ± 0.9 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 148
• Hermann-Mauguin space group symbol: R -3 :H
• Hall space group symbol: -R 3
• Residual factor for all reflections: 0.0664
• Residual factor for significantly intense reflections: 0.0475
• Weighted residual factors for significantly intense reflections: 0.1242
• Weighted residual factors for all reflections included in the refinement: 0.1817
• Goodness-of-fit parameter for all reflections included in the refinement: 1.124
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Duplicate of: 7102222
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No