Information card for entry 8104756

Structure parameters

• Formula: C24 H18 N4 O4
• Calculated formula: C24 H18 N4 O4
• Title of publication: Crystal structure of 2,6-bis(2-(pyridin-3-yl)ethyl)pyrrolo[3,4-f]isoindole-1,3,5,7(2H,6H)-tetraone, C24H18N4O4
• Authors of publication: Jeong, Yu Jeong; Park, Juhyeon; Min, Ahreum; Kim, Tae Ho; Choi, Myong Yong
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2021
• Journal volume: 236
• Journal issue: 3
• Pages of publication: 527 - 529
• a: 16.593 ± 0.0005 Å
• b: 5.7298 ± 0.0002 Å
• c: 20.8714 ± 0.0006 Å
• α: 90°
• β: 99.862 ± 0.001°
• γ: 90°
• Cell volume: 1955.02 ± 0.11 ų
• Cell temperature: 193 ± 2 K
• Ambient diffraction temperature: 193 ± 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: 0.0533
• Residual factor for significantly intense reflections: 0.0415
• Weighted residual factors for significantly intense reflections: 0.1036
• Weighted residual factors for all reflections included in the refinement: 0.1115
• Goodness-of-fit parameter for all reflections included in the refinement: 1.047
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No