Information card for entry 7037307

Structure parameters

• Formula: C46.5 H56 Cl3 F6 Fe2 N2 O3 P S2
• Calculated formula: C46.5 H56 Cl3 F6 Fe2 N2 O3 P S2
• Title of publication: Highly selective fluorescence sensors for the fluoride anion based on carboxylate-bridged diiron complexes.
• Authors of publication: Zhou, Yuhan; Dong, Xiaoliang; Zhang, Yixin; Tong, Peng; Qu, Jingping
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2016
• Journal volume: 45
• Journal issue: 16
• Pages of publication: 6839 - 6846
• a: 13.3872 ± 0.0004 Å
• b: 17.0602 ± 0.0006 Å
• c: 22.4013 ± 0.0007 Å
• α: 85.1417 ± 0.0015°
• β: 89.6624 ± 0.0015°
• γ: 75.2148 ± 0.0015°
• Cell volume: 4928.4 ± 0.3 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 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: 0.1153
• Residual factor for significantly intense reflections: 0.0685
• Weighted residual factors for significantly intense reflections: 0.1623
• Weighted residual factors for all reflections included in the refinement: 0.1798
• Goodness-of-fit parameter for all reflections included in the refinement: 1
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No