Information card for entry 7057515

Structure parameters

• Formula: C25 H29 N3 O2
• Calculated formula: C25 H29 N3 O2
• Title of publication: Heteroleptic Cu(i) complexes bearing methoxycarbonyl-imidoylindazole and POP ligands ‒ an experimental and theoretical study of their photophysical properties
• Authors of publication: González, Iván A.; Henríquez, Marco A.; Cortés-Arriagada, Diego; Natali, Mirco; Daniliuc, Constantin G.; Dreyse, Paulina; Maze, Jerónimo; Rojas, René S.; Salas, Cristian O.; Cabrera, Alan R.
• Journal of publication: New Journal of Chemistry
• Year of publication: 2018
• Journal volume: 42
• Journal issue: 15
• Pages of publication: 12576
• a: 20.0322 ± 0.0007 Å
• b: 5.8421 ± 0.0002 Å
• c: 19.3439 ± 0.0007 Å
• α: 90°
• β: 107.817 ± 0.001°
• γ: 90°
• Cell volume: 2155.24 ± 0.13 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• 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: 0.0581
• Residual factor for significantly intense reflections: 0.042
• Weighted residual factors for significantly intense reflections: 0.0994
• Weighted residual factors for all reflections included in the refinement: 0.1086
• Goodness-of-fit parameter for all reflections included in the refinement: 1.039
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No