Information card for entry 4084341

Structure parameters

• Common name: teop2aucl
• Formula: C38 H32 Au Cl5 O P2 Te
• Calculated formula: C38 H32 Au Cl5 O P2 Te
• SMILES: c12c(cccc2)[P](c2ccccc2)([Au]([P](c3c([Te]1=O)cccc3)(c1ccccc1)c1ccccc1)Cl)c1ccccc1.C(Cl)Cl.C(Cl)Cl
• Title of publication: Telluroether to Telluroxide Conversion in the Coordination Sphere of a Metal: Oxidation-Induced Umpolung of a Te‒Au Bond
• Authors of publication: Yang, Haifeng; Lin, Tzu-Pin; Gabbaï, François P.
• Journal of publication: Organometallics
• Year of publication: 2014
• Journal volume: 33
• Journal issue: 17
• Pages of publication: 4368
• a: 11.475 ± 0.002 Å
• b: 13.03 ± 0.003 Å
• c: 14.275 ± 0.003 Å
• α: 98.479 ± 0.002°
• β: 109.941 ± 0.002°
• γ: 99.162 ± 0.002°
• Cell volume: 1933.4 ± 0.7 ų
• Cell temperature: 97 ± 2 K
• Ambient diffraction temperature: 97 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0483
• Residual factor for significantly intense reflections: 0.0414
• Weighted residual factors for significantly intense reflections: 0.1078
• Weighted residual factors for all reflections included in the refinement: 0.1119
• Goodness-of-fit parameter for all reflections included in the refinement: 1.054
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No