Information card for entry 4308548

Structure parameters

• Formula: C21 H25 Cl2 Cu N3 O4
• Calculated formula: C21 H23 Cl2 Cu N3 O4
• Title of publication: Hydrolytic Protein Cleavage Mediated by Unusual Mononuclear Copper(II) Complexes: X-ray Structures and Solution Studies
• Authors of publication: Mauricio C. B. de Oliveira; Marciela Scarpellini; Ademir Neves; Hernán Terenzi; Adailton J. Bortoluzzi; Bruno Szpoganics; Alessandra Greatti; Antônio S. Mangrich; Emanuel M. de Souza; Pablo M. Fernandez; Marcia R. Soares
• Journal of publication: Inorganic Chemistry
• Year of publication: 2005
• Journal volume: 44
• Pages of publication: 921 - 929
• a: 7.807 ± 0.0016 Å
• b: 8.8175 ± 0.0018 Å
• c: 17.929 ± 0.004 Å
• α: 103.89 ± 0.03°
• β: 90.74 ± 0.03°
• γ: 110.61 ± 0.03°
• Cell volume: 1115 ± 0.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0502
• Residual factor for significantly intense reflections: 0.0311
• Weighted residual factors for significantly intense reflections: 0.0823
• Weighted residual factors for all reflections included in the refinement: 0.0857
• Goodness-of-fit parameter for all reflections included in the refinement: 1.067
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No