Information card for entry 7240101

Structure parameters

• Formula: C15 H18 N4 O
• Calculated formula: C15 H18 N4 O
• Title of publication: Photophysical transformations induced by chemical substitution to salicylaldimines.
• Authors of publication: Barboza, Cristina A.; Gawrys, Pawel; Banasiewicz, Marzena; Suwinska, Kinga; Sobolewski, Andrzej L.
• Journal of publication: Physical chemistry chemical physics : PCCP
• Year of publication: 2020
• Journal volume: 22
• Journal issue: 12
• Pages of publication: 6698 - 6705
• a: 7.175 ± 0.003 Å
• b: 14.95 ± 0.008 Å
• c: 13.418 ± 0.012 Å
• α: 90°
• β: 95.31 ± 0.03°
• γ: 90°
• Cell volume: 1433.1 ± 1.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.1043
• Residual factor for significantly intense reflections: 0.0588
• Weighted residual factors for significantly intense reflections: 0.1132
• Weighted residual factors for all reflections included in the refinement: 0.1292
• Goodness-of-fit parameter for all reflections included in the refinement: 1.053
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No