Information card for entry 7008750

Structure parameters

• Formula: C47.5 H39 Ag Cl F3 Fe O3 P2 S2
• Calculated formula: C47.5 H39 Ag Cl F3 Fe O3 P2 S2
• Title of publication: Group 11 complexes with unsymmetrical P,S and P,Se disubstituted ferrocene ligands.
• Authors of publication: Aguado, Javier E.; Canales, Silvia; Gimeno, M Concepción; Jones, Peter G.; Laguna, Antonio; Villacampa, M. Dolores
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2005
• Journal issue: 18
• Pages of publication: 3005 - 3015
• a: 10.7313 ± 0.0008 Å
• b: 18.2674 ± 0.0014 Å
• c: 22.6389 ± 0.0016 Å
• α: 90°
• β: 97.837 ± 0.003°
• γ: 90°
• Cell volume: 4396.5 ± 0.6 ų
• Cell temperature: 143 ± 2 K
• Ambient diffraction temperature: 143 ± 2 K
• Number of distinct elements: 9
• 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: 0.0497
• Residual factor for significantly intense reflections: 0.0313
• Weighted residual factors for significantly intense reflections: 0.0719
• Weighted residual factors for all reflections included in the refinement: 0.08
• Goodness-of-fit parameter for all reflections included in the refinement: 1.013
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No