Information card for entry 7135497

Structure parameters

• Formula: C25 H19 N O3 S
• Calculated formula: C25 H19 N O3 S
• Title of publication: Photocatalytic oxidative cyclopropanation of aza-1,6-enynes: construction of 3-aza-bicyclo[3.1.0]hexane derivatives.
• Authors of publication: Meena, Shivam A.; Thakur, Deepika; Tripathi, Surya P.; Ranjan, Rahul; Verma, Akhilesh K.
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2026
• Journal volume: 62
• Journal issue: 8
• Pages of publication: 2641 - 2645
• a: 29.481 ± 0.005 Å
• b: 6.8544 ± 0.0003 Å
• c: 15.489 ± 0.003 Å
• α: 90°
• β: 138.05 ± 0.04°
• γ: 90°
• Cell volume: 2092.3 ± 1.7 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• 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: 0.1557
• Residual factor for significantly intense reflections: 0.1225
• Weighted residual factors for significantly intense reflections: 0.3044
• Weighted residual factors for all reflections included in the refinement: 0.3454
• Goodness-of-fit parameter for all reflections included in the refinement: 1.297
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No