Information card for entry 7711188

Structure parameters

• Formula: C37 H38 Cl3 Fe N O1.5 P2 Pd
• Calculated formula: C36 H36 Cl2 Fe N O1.5 P2 Pd
• Title of publication: Synthesis and coordination of hybrid phosphinoferrocenes with extended donor pendants
• Authors of publication: Navratil, Michal; Cisarova, Ivana; Štěpnička, Petr
• Journal of publication: Dalton Transactions
• Year of publication: 2022
• a: 14.6271 ± 0.0003 Å
• b: 19.8015 ± 0.0004 Å
• c: 25.4081 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 7359.2 ± 0.3 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 8
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0267
• Residual factor for significantly intense reflections: 0.0243
• Weighted residual factors for significantly intense reflections: 0.0459
• Weighted residual factors for all reflections included in the refinement: 0.0466
• Goodness-of-fit parameter for all reflections included in the refinement: 1.049
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No