Information card for entry 7135037

Structure parameters

• Formula: C14 H14 N4 O
• Calculated formula: C14 H14 N4 O
• Title of publication: Rh(III)-catalyzed cyclization of 5-amino-pyrazoles with maleimides to pyrazoloquinazolines.
• Authors of publication: Guo, Ting-Ting; Zhao, Qing-Sheng; Yang, Shu; Chen, Tian-Tian; Liu, Jin; Yan, Sheng-Jiao
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2025
• Journal volume: 61
• Journal issue: 86
• Pages of publication: 16846 - 16849
• a: 10.6661 ± 0.0004 Å
• b: 4.919 ± 0.0002 Å
• c: 23.7529 ± 0.001 Å
• α: 90°
• β: 102.205 ± 0.002°
• γ: 90°
• Cell volume: 1218.06 ± 0.09 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0582
• Residual factor for significantly intense reflections: 0.045
• Weighted residual factors for significantly intense reflections: 0.1038
• Weighted residual factors for all reflections included in the refinement: 0.1129
• Goodness-of-fit parameter for all reflections included in the refinement: 1.046
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No