Information card for entry 1573416

Structure parameters

• Formula: C38 H46 N2 O12 W2
• Calculated formula: C38 H46 N2 O12 W2
• Title of publication: Tungsten-catalyzed stereodivergent isomerization of terminal olefins.
• Authors of publication: Jankins, Tanner C.; Rubel, Camille Z.; Ho, Hang Chi; Martin-Montero, Raul; Engle, Keary M.
• Journal of publication: Chemical science
• Year of publication: 2025
• Journal volume: 16
• Journal issue: 5
• Pages of publication: 2307 - 2315
• a: 8.9455 ± 0.0007 Å
• b: 10.6935 ± 0.0007 Å
• c: 12.0535 ± 0.0008 Å
• α: 66.56 ± 0.002°
• β: 71.07 ± 0.002°
• γ: 71.049 ± 0.002°
• Cell volume: 974.88 ± 0.12 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0545
• Residual factor for significantly intense reflections: 0.0419
• Weighted residual factors for significantly intense reflections: 0.0921
• Weighted residual factors for all reflections included in the refinement: 0.0962
• Goodness-of-fit parameter for all reflections included in the refinement: 1.028
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Diffraction radiation X-ray symbol: K-L~3~
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No