Information card for entry 4348648

Structure parameters

• Chemical name: Unk
• Formula: C70 H80 Cl2 Fe2 N10 O15
• Calculated formula: C70 H80 Cl2 Fe2 N10 O15
• Title of publication: Dioxygen Reactivity of an Iron Complex of 2-Aminophenol-Appended Ligand: Crystallographic Evidence of the Aromatic Ring Cleavage Product of the 2-Aminophenol Unit.
• Authors of publication: Paul, Ganesh Chandra; Banerjee, Sridhar; Mukherjee, Chandan
• Journal of publication: Inorganic chemistry
• Year of publication: 2017
• Journal volume: 56
• Journal issue: 2
• Pages of publication: 729 - 736
• a: 15.2994 ± 0.0003 Å
• b: 13.1099 ± 0.0003 Å
• c: 18.3192 ± 0.0004 Å
• α: 90°
• β: 93.079 ± 0.002°
• γ: 90°
• Cell volume: 3669.04 ± 0.14 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0595
• Residual factor for significantly intense reflections: 0.0458
• Weighted residual factors for significantly intense reflections: 0.1091
• Weighted residual factors for all reflections included in the refinement: 0.1178
• Goodness-of-fit parameter for all reflections included in the refinement: 1.049
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No