Information card for entry 4515242

Structure parameters

• Formula: C42 H50 Cu N2 O2
• Calculated formula: C42 H50 Cu N2 O2
• Title of publication: Unprecedented Copper(II) Complex with a Topoquinone-like Moiety as a Structural and Functional Mimic for Copper Amine Oxidase: Role of Copper(II) in the Genesis and Amine Oxidase Activity
• Authors of publication: Jangir, Ritambhara; Ansari, Mursaleem; Kaleeswaran, Dhananjayan; Rajaraman, Gopalan; Palaniandavar, Mallayan; Murugavel, Ramaswamy
• Journal of publication: ACS Catalysis
• Year of publication: 2019
• Pages of publication: 10940
• a: 21.901 ± 0.014 Å
• b: 24.944 ± 0.016 Å
• c: 29.952 ± 0.018 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 16363 ± 18 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 70
• Hermann-Mauguin space group symbol: F d d d :2
• Hall space group symbol: -F 2uv 2vw
• Residual factor for all reflections: 0.1441
• Residual factor for significantly intense reflections: 0.1263
• Weighted residual factors for significantly intense reflections: 0.3451
• Weighted residual factors for all reflections included in the refinement: 0.3622
• Goodness-of-fit parameter for all reflections included in the refinement: 1.139
• Diffraction radiation wavelength: 1.54187 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No