Information card for entry 7702600

Structure parameters

• Common name: CORTADO
• Formula: C62 H30 Au2 F30 Fe N2 S2
• Calculated formula: C62 H16 Au2 F30 Fe N2 S2
• Title of publication: 1,1′-Bis(2-pyridylthio)ferrocene: a new ligand in gold and silver chemistry
• Authors of publication: Barranco, Eva M.; Crespo, Olga; Gimeno, M. Concepción; Jones, Peter G.; Laguna, Antonio; Sarroca, Cristina
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 2001
• Journal issue: 17
• Pages of publication: 2523
• a: 9.2447 ± 0.0016 Å
• b: 12.7873 ± 0.0018 Å
• c: 13.5004 ± 0.0018 Å
• α: 82.283 ± 0.01°
• β: 78.168 ± 0.012°
• γ: 74.357 ± 0.01°
• Cell volume: 1498.9 ± 0.4 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 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: 0.0423
• Residual factor for significantly intense reflections: 0.0323
• Weighted residual factors for all reflections: 0.0763
• Weighted residual factors for significantly intense reflections: 0.0738
• Goodness-of-fit parameter for all reflections: 0.956
• Goodness-of-fit parameter for significantly intense reflections: 1.022
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No