Information card for entry 7160345

Structure parameters

• Formula: C24 H19 Cl N2 O6
• Calculated formula: C24 H19 Cl N2 O6
• Title of publication: Microwave-assisted [3 + 2] cycloaddition reactions of dicyanoepoxides with benzylidene Meldrum's acids.
• Authors of publication: Lotfi Nosood, Yazdanbakhsh; Fattahi Ghahnavieh, Negin; Takallou, Ahmad; Rostami, Ali; Ebrahimi, Amirhossein; Anwar, Muhammad U.; Al-Harrasi, Ahmed
• Journal of publication: Organic & biomolecular chemistry
• Year of publication: 2025
• Journal volume: 23
• Journal issue: 17
• Pages of publication: 4084 - 4089
• a: 8.8296 ± 0.0004 Å
• b: 23.8348 ± 0.0013 Å
• c: 12.1335 ± 0.0007 Å
• α: 90°
• β: 109.541 ± 0.002°
• γ: 90°
• Cell volume: 2406.4 ± 0.2 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• 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: 0.1126
• Residual factor for significantly intense reflections: 0.0676
• Weighted residual factors for significantly intense reflections: 0.1461
• Weighted residual factors for all reflections included in the refinement: 0.1804
• Goodness-of-fit parameter for all reflections included in the refinement: 1.065
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No