Information card for entry 7047386

Structure parameters

• Formula: C16 H14 Cl3 Fe N2 O2
• Calculated formula: C16 H14 Cl3 Fe N2 O2
• Title of publication: Stable Fe(iii) phenoxyimines as selective and robust CO₂/epoxide coupling catalysts.
• Authors of publication: Fazekas, Eszter; Nichol, Gary S.; Shaver, Michael P.; Garden, Jennifer A.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2018
• Journal volume: 47
• Journal issue: 37
• Pages of publication: 13106 - 13112
• a: 23.1547 ± 0.0003 Å
• b: 12.00241 ± 0.00014 Å
• c: 12.99462 ± 0.00016 Å
• α: 90°
• β: 102.417 ± 0.0012°
• γ: 90°
• Cell volume: 3526.89 ± 0.08 ų
• Cell temperature: 120 K
• Ambient diffraction temperature: 120 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0431
• Residual factor for significantly intense reflections: 0.0406
• Weighted residual factors for significantly intense reflections: 0.107
• Weighted residual factors for all reflections included in the refinement: 0.1092
• Goodness-of-fit parameter for all reflections included in the refinement: 1.03
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No