Information card for entry 7133363

Structure parameters

• Formula: C22 H21 Cl Cu N6 O6
• Calculated formula: C22 H21 Cl Cu N6 O6
• Title of publication: Spectroscopic characterization and reactivity studies of a copper(II) iminoxyl radical complex.
• Authors of publication: Kaur, Simarjeet; Das, Avijit; Velasco, Lucia; Sauvan, Maxime; Bera, Moumita; Ugale, Ashok; Charisiadis, Asterios; Moonshiram, Dooshaye; Paria, Sayantan
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2024
• Journal volume: 60
• Journal issue: 73
• Pages of publication: 9934 - 9937
• a: 10.905 ± 0.006 Å
• b: 19.645 ± 0.01 Å
• c: 11.608 ± 0.006 Å
• α: 90°
• β: 104.342 ± 0.017°
• γ: 90°
• Cell volume: 2409 ± 2 ų
• Cell temperature: 300 ± 2 K
• Ambient diffraction temperature: 300 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: 0.1846
• Residual factor for significantly intense reflections: 0.0846
• Weighted residual factors for significantly intense reflections: 0.1726
• Weighted residual factors for all reflections included in the refinement: 0.2198
• Goodness-of-fit parameter for all reflections included in the refinement: 1.1385
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No