Information card for entry 8106731

Structure parameters

• Formula: C40 H38 Cu N4 O6
• Calculated formula: C40 H38 Cu N4 O6
• Title of publication: Crystal structure of bis{5-(diethylamino)-2-(((2-oxo-2H-chromen-6-yl)imino)methyl)phenolato-κ2 O,N}copper(II), C40H38CuN4O6
• Authors of publication: Li, Jing; Jia, Hao-Ran; Sun, Yin-Xia
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2017
• Journal volume: 232
• Journal issue: 6
• Pages of publication: 947 - 949
• a: 10.59 ± 0.004 Å
• b: 7.273 ± 0.003 Å
• c: 23.345 ± 0.009 Å
• α: 90°
• β: 102.347 ± 0.007°
• γ: 90°
• Cell volume: 1756.5 ± 1.2 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• 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: 0.1296
• Residual factor for significantly intense reflections: 0.0682
• Weighted residual factors for significantly intense reflections: 0.1876
• Weighted residual factors for all reflections included in the refinement: 0.2373
• Goodness-of-fit parameter for all reflections included in the refinement: 0.909
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No