Information card for entry 7708423

Structure parameters

• Formula: C58 H70 Cl2 F12 Fe2 N6 P2 Pd Sb2
• Calculated formula: C58 H70 Cl2 F12 Fe2 N6 P2 Pd Sb2
• Title of publication: The protonation state governs the coordination of phosphinoferrocene guanidines
• Authors of publication: Ondrej, Barta; Cisarova, Ivana; Štěpnička, Petr
• Journal of publication: Dalton Transactions
• Year of publication: 2021
• a: 9.8295 ± 0.0016 Å
• b: 10.7854 ± 0.0017 Å
• c: 16.81 ± 0.002 Å
• α: 90.376 ± 0.008°
• β: 104.974 ± 0.006°
• γ: 112.399 ± 0.005°
• Cell volume: 1580.7 ± 0.4 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 9
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0438
• Residual factor for significantly intense reflections: 0.0364
• Weighted residual factors for significantly intense reflections: 0.0759
• Weighted residual factors for all reflections included in the refinement: 0.0785
• Goodness-of-fit parameter for all reflections included in the refinement: 1.122
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No