Information card for entry 7125580

Structure parameters

• Formula: C22 H18 B2 F8 Fe N10
• Calculated formula: C22 H18 B2 F8 Fe N10
• Title of publication: Light induced excited high spin-state trapping in [FeL2](BF4)2 (L = 2,6-di(pyrazol-1-yl)pyridine).
• Authors of publication: Money, Victoria A.; Evans, Ivana Radosavljevic; Halcrow, Malcolm A.; Goeta, Andrés E; Howard, Judith A. K.
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2003
• Journal issue: 1
• Pages of publication: 158 - 159
• a: 8.4615 ± 0.0017 Å
• b: 8.3695 ± 0.0017 Å
• c: 18.759 ± 0.004 Å
• α: 90°
• β: 97.15 ± 0.03°
• γ: 90°
• Cell volume: 1318.2 ± 0.5 ų
• Cell temperature: 30 ± 2 K
• Ambient diffraction temperature: 30 ± 2 K
• Number of distinct elements: 6
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.031
• Residual factor for significantly intense reflections: 0.0296
• Weighted residual factors for significantly intense reflections: 0.0749
• Weighted residual factors for all reflections included in the refinement: 0.0759
• Goodness-of-fit parameter for all reflections included in the refinement: 1.058
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No