Information card for entry 7055563

Structure parameters

• Formula: C28 H28 O4 P2
• Calculated formula: C28 H28 O4 P2
• SMILES: c1(ccccc1OC)P(c1ccccc1OC)P(c1ccccc1OC)c1ccccc1OC
• Title of publication: Synthesis and Solid-State Structures of Gold(I) Complexes of Diphosphines
• Authors of publication: Molitor, Sebastian; Mahler, Christoph; Gessner, Viktoria H.
• Journal of publication: New J. Chem.
• Year of publication: 2016
• a: 14.3337 ± 0.0013 Å
• b: 8.0972 ± 0.0007 Å
• c: 21.2171 ± 0.0019 Å
• α: 90°
• β: 91.838 ± 0.003°
• γ: 90°
• Cell volume: 2461.2 ± 0.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0545
• Residual factor for significantly intense reflections: 0.0431
• Weighted residual factors for significantly intense reflections: 0.1095
• Weighted residual factors for all reflections included in the refinement: 0.1157
• Goodness-of-fit parameter for all reflections included in the refinement: 1.035
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No