Information card for entry 7045348

Structure parameters

• Formula: C15 H23 Au Cl Fe P Si
• Calculated formula: C15 H23 Au Cl Fe P Si
• SMILES: [Au]([P](C)(C)C)[c]12[cH]3[Fe]4567891([cH]3[cH]4[cH]25)[c]1([Si](Cl)(C)C)[cH]6[cH]7[cH]8[cH]91
• Title of publication: New Reactivity at the Silicon Bridge in Sila[1]ferrocenophanes
• Authors of publication: Musgrave, Rebecca Alice; Hailes, Rebekah; Schäfer, André; Russell, Andrew David; Gates, Paul Jonathan; Manners, Ian
• Journal of publication: Dalton Transactions
• Year of publication: 2018
• a: 7.473 ± 0.005 Å
• b: 9.66 ± 0.007 Å
• c: 12.93 ± 0.009 Å
• α: 76.909 ± 0.016°
• β: 81.91 ± 0.02°
• γ: 80.681 ± 0.014°
• Cell volume: 891.9 ± 1.1 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0185
• Residual factor for significantly intense reflections: 0.0154
• Weighted residual factors for significantly intense reflections: 0.033
• Weighted residual factors for all reflections included in the refinement: 0.0338
• Goodness-of-fit parameter for all reflections included in the refinement: 1.062
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No