Information card for entry 7720450

Structure parameters

• Common name: n/a
• Chemical name: n/a
• Formula: C22 H36 Cl8 Fe3 N8
• Calculated formula: C22 H36 Cl8 Fe3 N8
• Title of publication: Photoactive Fe(III) pyclen complexes for light-driven aerobic oxidation of <i>p</i>-xylene.
• Authors of publication: Alberti, Matteo; Rossi, Greta; Boucherabine, Djihed; Cargnoni, Fausto; Trioni, Mario Italo; Taini, Giulia; Zakutna, Dominika; Gentilin, Arianna; Đorđević, Luka; Sartorel, Andrea; Caselli, Alessandro
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2026
• Journal volume: 55
• Journal issue: 4
• Pages of publication: 1716 - 1726
• a: 27.7537 ± 0.001 Å
• b: 8.7587 ± 0.0004 Å
• c: 7.0757 ± 0.0003 Å
• α: 90°
• β: 90.105 ± 0.004°
• γ: 90°
• Cell volume: 1720 ± 0.12 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 0.1 K
• Number of distinct elements: 5
• Space group number: 12
• Hermann-Mauguin space group symbol: C 1 2/m 1
• Hall space group symbol: -C 2y
• Residual factor for all reflections: 0.0839
• Residual factor for significantly intense reflections: 0.0676
• Weighted residual factors for significantly intense reflections: 0.1715
• Weighted residual factors for all reflections included in the refinement: 0.1914
• Goodness-of-fit parameter for all reflections included in the refinement: 1.0324
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No