Information card for entry 7127498

Structure parameters

• Formula: C38 H35 N O5
• Calculated formula: C38 H35 N O5
• Title of publication: A silver-catalyzed stereoselective domino cycloisomerization-vinylogous aldol reaction of <i>ortho</i>-alkynylbenzaldehydes with 3-alkylidene oxindoles: an entry to functionalized isochromenes.
• Authors of publication: Kumar, Krishna; Singh, Bhuvnesh; Singh, Ravi P.
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2020
• Journal volume: 56
• Journal issue: 96
• Pages of publication: 15153 - 15156
• a: 10.5434 ± 0.0007 Å
• b: 12.209 ± 0.0008 Å
• c: 12.9764 ± 0.0009 Å
• α: 89.428 ± 0.002°
• β: 77.02 ± 0.002°
• γ: 75.639 ± 0.002°
• Cell volume: 1574.99 ± 0.18 ų
• Cell temperature: 302 ± 2 K
• Ambient diffraction temperature: 302 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1151
• Residual factor for significantly intense reflections: 0.0626
• Weighted residual factors for significantly intense reflections: 0.1645
• Weighted residual factors for all reflections included in the refinement: 0.202
• Goodness-of-fit parameter for all reflections included in the refinement: 0.924
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No