Information card for entry 4101584

Structure parameters

• Formula: C19 H24 O2 S2
• Calculated formula: C19 H24 O2 S2
• Title of publication: Efficient catalytic insertion of acetylenes into a carbon-carbon single bond of nonstrained cyclic compounds under mild conditions.
• Authors of publication: Kuninobu, Yoichiro; Kawata, Atsushi; Takai, Kazuhiko
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2006
• Journal volume: 128
• Journal issue: 35
• Pages of publication: 11368 - 11369
• a: 8.37 ± 0.0003 Å
• b: 21.881 ± 0.001 Å
• c: 10.1712 ± 0.0006 Å
• α: 90°
• β: 103.659 ± 0.003°
• γ: 90°
• Cell volume: 1810.1 ± 0.2 ų
• Cell temperature: 296.2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for significantly intense reflections: 0.0743
• Weighted residual factors for all reflections included in the refinement: 0.244
• Goodness-of-fit parameter for all reflections included in the refinement: 2.171
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No