Information card for entry 7708415

Structure parameters

• Formula: C60 H74 Cl8 F12 Fe2 N6 P2 Pd2 Sb2
• Calculated formula: C60 H74 Cl8 F12 Fe2 N6 P2 Pd2 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: 13.7155 ± 0.0009 Å
• b: 15.3996 ± 0.0011 Å
• c: 19.7573 ± 0.0014 Å
• α: 88.358 ± 0.002°
• β: 85.451 ± 0.002°
• γ: 65.734 ± 0.002°
• Cell volume: 3792.3 ± 0.5 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 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: 0.066
• Residual factor for significantly intense reflections: 0.0493
• Weighted residual factors for significantly intense reflections: 0.128
• Weighted residual factors for all reflections included in the refinement: 0.1377
• Goodness-of-fit parameter for all reflections included in the refinement: 1.031
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No