Information card for entry 7035886

Structure parameters

• Formula: C26 H39 F12 Fe N10 P3
• Calculated formula: C26 H39 F12 Fe N10 P3
• Title of publication: Structural diversity of late transition metal complexes with flexible tetra-NHC ligands.
• Authors of publication: Weiss, Daniel T.; Altmann, Philipp J.; Haslinger, Stefan; Jandl, Christian; Pöthig, Alexander; Cokoja, Mirza; Kühn, Fritz E
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2015
• Journal volume: 44
• Journal issue: 42
• Pages of publication: 18329 - 18339
• a: 12.5032 ± 0.0003 Å
• b: 14.0746 ± 0.0004 Å
• c: 20.8711 ± 0.0005 Å
• α: 90°
• β: 90.077 ± 0.001°
• γ: 90°
• Cell volume: 3672.84 ± 0.16 ų
• Cell temperature: 123 K
• Ambient diffraction temperature: 123 K
• Number of distinct elements: 6
• 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: 0.0605
• Residual factor for significantly intense reflections: 0.0405
• Weighted residual factors for significantly intense reflections: 0.0819
• Weighted residual factors for all reflections included in the refinement: 0.0894
• Goodness-of-fit parameter for all reflections included in the refinement: 1.048
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No