Information card for entry 7063943

Structure parameters

• Formula: C44 H42 F12 Fe N2 P4 Pd
• Calculated formula: C44 H42 F12 Fe N2 P4 Pd
• Title of publication: Synthesis and coordination behaviour of a protic phosphinoferrocene amidine
• Authors of publication: Leitner, Zdeněk; Císařová, Ivana; Kalbáčová Vejpravová, Jana; Štěpnička, Petr
• Journal of publication: New Journal of Chemistry
• Year of publication: 2025
• Journal volume: 49
• Journal issue: 36
• Pages of publication: 15723 - 15735
• a: 10.4519 ± 0.0004 Å
• b: 14.382 ± 0.0006 Å
• c: 15.3656 ± 0.0006 Å
• α: 79.91 ± 0.001°
• β: 74.356 ± 0.001°
• γ: 82.845 ± 0.001°
• Cell volume: 2182.49 ± 0.15 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 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: 0.0221
• Residual factor for significantly intense reflections: 0.0212
• Weighted residual factors for significantly intense reflections: 0.0525
• Weighted residual factors for all reflections included in the refinement: 0.053
• Goodness-of-fit parameter for all reflections included in the refinement: 1.044
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No