Information card for entry 1547389

Structure parameters

• Formula: C63 H47 O4 P Si2
• Calculated formula: C63 H47 O4 P Si2
• SMILES: P1(Oc2c([Si](c3ccccc3)(c3ccccc3)c3ccccc3)cc3c(c2c2c(O1)c([Si](c1ccccc1)(c1ccccc1)c1ccccc1)cc1c2cccc1)cccc3)Oc1ccc(OC)cc1
• Title of publication: Modular chiral gold(i) phosphite complexes
• Authors of publication: Nicolas Delpont; Imma Escofet; Patricia Perez-Galen; Dirk Spiegl; Mihai Raducan; Christophe Bour; Riccardo Sinisi; Antonio M. Echavarrena
• Journal of publication: Catalysis Science & Technology
• Year of publication: 2013
• Journal volume: 3
• Pages of publication: 3007 - 3012
• a: 11.6873 ± 0.0011 Å
• b: 13.7576 ± 0.0019 Å
• c: 34.499 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5547.1 ± 1.1 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0678
• Residual factor for significantly intense reflections: 0.0597
• Weighted residual factors for significantly intense reflections: 0.1597
• Weighted residual factors for all reflections included in the refinement: 0.1652
• Goodness-of-fit parameter for all reflections included in the refinement: 1.269
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No