Information card for entry 7135021

Structure parameters

• Chemical name: YD_YP_BIS_1631_YP
• Formula: C78 H78 O12
• Calculated formula: C78 H78 O12
• Title of publication: Light-induced intramolecular carbene C(sp³)-H insertion of <i>N</i>-tosylhydrazones; synthesis of functionalized coumarans and indolines.
• Authors of publication: Yamini, Pokhriyal; Duklan, Bhoomika; Nirmal, Mukesh; Yadagiri, Dongari
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2025
• Journal volume: 61
• Journal issue: 87
• Pages of publication: 17017 - 17020
• a: 6.0018 ± 0.0002 Å
• b: 16.2806 ± 0.0005 Å
• c: 16.8345 ± 0.0005 Å
• α: 107.589 ± 0.001°
• β: 97.731 ± 0.001°
• γ: 95.825 ± 0.001°
• Cell volume: 1536.1 ± 0.08 ų
• Cell temperature: 103 K
• Ambient diffraction temperature: 103 K
• Number of distinct elements: 3
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0986
• Residual factor for significantly intense reflections: 0.0706
• Weighted residual factors for significantly intense reflections: 0.1749
• Weighted residual factors for all reflections included in the refinement: 0.1958
• Goodness-of-fit parameter for all reflections included in the refinement: 1.033
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No