Information card for entry 7017701

Structure parameters

• Formula: C16 H18 F12 Fe N2 O4
• Calculated formula: C16 H18 F12 Fe N2 O4
• SMILES: [Fe]123(OC(=CC(=[O]1)C(F)(F)F)C(F)(F)F)([O]=C(C=C(O2)C(F)(F)F)C(F)(F)F)[N](CC[N]3(C)C)(C)C
• Title of publication: β-Fe2O3 nanomaterials from an iron(II) diketonate-diamine complex: a study from molecular precursor to growth process.
• Authors of publication: Barreca, Davide; Carraro, Giorgio; Devi, Anjana; Fois, Ettore; Gasparotto, Alberto; Seraglia, Roberta; Maccato, Chiara; Sada, Cinzia; Tabacchi, Gloria; Tondello, Eugenio; Venzo, Alfonso; Winter, Manuela
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2012
• Journal volume: 41
• Journal issue: 1
• Pages of publication: 149 - 155
• a: 13.2238 ± 0.0005 Å
• b: 10.403 ± 0.0003 Å
• c: 17.1899 ± 0.0006 Å
• α: 90°
• β: 107.653 ± 0.004°
• γ: 90°
• Cell volume: 2253.41 ± 0.14 ų
• Cell temperature: 104 ± 2 K
• Ambient diffraction temperature: 104 ± 2 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: 0.0311
• Residual factor for significantly intense reflections: 0.026
• Weighted residual factors for significantly intense reflections: 0.0627
• Weighted residual factors for all reflections included in the refinement: 0.0658
• Goodness-of-fit parameter for all reflections included in the refinement: 1.053
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No