Information card for entry 4104710

Structure parameters

• Formula: C36 H58 Au2 Cl2 P2
• Calculated formula: C36 H58 Au2 Cl2 P2
• SMILES: [Au](Cl)[P](=[P](c1c(cc(cc1C(C)(C)C)C(C)(C)C)C(C)(C)C)\[Au]Cl)\c1c(cc(cc1C(C)(C)C)C(C)(C)C)C(C)(C)C
• Title of publication: Unusual Phosphorus-Phosphorus Double Bond Contraction upon Mono- and Di-auration of a Diphosphene
• Authors of publication: David V. Partyka; Marlena P. Washington; Thomas G. Gray; James B. Updegraff III; John F. Turner; John D. Protasiewicz
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2009
• Journal volume: 131
• Pages of publication: 10041 - 10048
• a: 8.8414 ± 0.0013 Å
• b: 9.2149 ± 0.0014 Å
• c: 12.2231 ± 0.0014 Å
• α: 99.669 ± 0.002°
• β: 99.41 ± 0.002°
• γ: 99.408 ± 0.003°
• Cell volume: 949.6 ± 0.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0534
• Residual factor for significantly intense reflections: 0.0461
• Weighted residual factors for significantly intense reflections: 0.1284
• Weighted residual factors for all reflections included in the refinement: 0.1376
• Goodness-of-fit parameter for all reflections included in the refinement: 1.121
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No