Information card for entry 4300041

Structure parameters

• Formula: C29 H21 Au F5 Fe P
• Calculated formula: C29 H21 Au F5 Fe P
• SMILES: [Au]([P](C[c]12[cH]3[Fe]4567891([cH]3[cH]4[cH]25)[cH]1[cH]6[cH]7[cH]8[cH]91)(c1ccccc1)c1ccccc1)c1c(c(c(c(c1F)F)F)F)F
• Title of publication: Gold and Silver Complexes with the Ferrocenyl Phosphine FcCH2PPh2 [Fc = (η5-C5H5)Fe(η5-C5H4)]
• Authors of publication: Eva M. Barranco; Olga Crespo; M. Concepción Gimeno; Antonio Laguna; Peter G. Jones; Birte Ahrens
• Journal of publication: Inorganic Chemistry
• Year of publication: 2000
• Journal volume: 39
• Pages of publication: 680 - 687
• a: 10.9599 ± 0.0018 Å
• b: 11.049 ± 0.002 Å
• c: 12.5618 ± 0.0018 Å
• α: 115.374 ± 0.014°
• β: 109.135 ± 0.012°
• γ: 94.918 ± 0.014°
• Cell volume: 1252.1 ± 0.4 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0437
• Residual factor for significantly intense reflections: 0.0298
• Weighted residual factors for all reflections: 0.0522
• Weighted residual factors for significantly intense reflections: 0.0503
• Goodness-of-fit parameter for all reflections: 0.888
• Goodness-of-fit parameter for significantly intense reflections: 0.963
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No