Information card for entry 4104430

Structure parameters

• Common name: dcpm(AuBr)(AuBr3)
• Formula: C25 H46 Au2 Br4 P2
• Calculated formula: C25 H46 Au2 Br4 P2
• SMILES: [Au](Br)([P](C[P]([Au]Br)(C1CCCCC1)C1CCCCC1)(C1CCCCC1)C1CCCCC1)(Br)Br
• Title of publication: Halogen Photoreductive Elimination from Gold(III) Centers
• Authors of publication: Thomas S. Teets; Daniel G. Nocera
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2009
• Journal volume: 131
• Pages of publication: 7411 - 7420
• a: 11.7519 ± 0.0009 Å
• b: 14.3982 ± 0.001 Å
• c: 19.2592 ± 0.0014 Å
• α: 90°
• β: 95.461 ± 0.001°
• γ: 90°
• Cell volume: 3244 ± 0.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0444
• Residual factor for significantly intense reflections: 0.0319
• Weighted residual factors for significantly intense reflections: 0.0748
• Weighted residual factors for all reflections included in the refinement: 0.0805
• Goodness-of-fit parameter for all reflections included in the refinement: 1.048
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No