Information card for entry 8105603

Structure parameters

• Formula: C36 H42 Cu N6 O7
• Calculated formula: C36 H42 Cu N6 O7
• Title of publication: Crystal structure of ethanol-bis(N-((5-(ethoxycarbonyl)-3,4-dimethyl-1H-pyrrol-2-yl)methylene)benzohydrazonato-κ 2 N,O)copper(II), C36H42N6O7Cu
• Authors of publication: Xue, Wen-Zhao; Hu, Qiang; Song, Yu-Fei; Wu, Wei-Na
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2019
• Journal volume: 234
• Journal issue: 2
• Pages of publication: 239 - 241
• a: 8.482 ± 0.006 Å
• b: 15.272 ± 0.012 Å
• c: 15.285 ± 0.012 Å
• α: 112.024 ± 0.011°
• β: 95.325 ± 0.009°
• γ: 98.958 ± 0.009°
• Cell volume: 1788 ± 2 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0787
• Residual factor for significantly intense reflections: 0.057
• Weighted residual factors for significantly intense reflections: 0.15
• Weighted residual factors for all reflections included in the refinement: 0.1687
• Goodness-of-fit parameter for all reflections included in the refinement: 1.059
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No