Information card for entry 1553800

Structure parameters

• Formula: C22 H26 N4 O6
• Calculated formula: C22 H26 N4 O6
• Title of publication: Gold(i)-catalyzed access to neomerane skeletons
• Authors of publication: Tugny, Coralie; Khaled, Omar; Derat, Etienne; Goddard, Jean-Philippe; Mouriès-Mansuy, Virginie; Fensterbank, Louis
• Journal of publication: Organic Chemistry Frontiers
• Year of publication: 2017
• Journal volume: 4
• Journal issue: 10
• Pages of publication: 1906
• a: 8.7959 ± 0.0005 Å
• b: 10.4916 ± 0.0006 Å
• c: 13.2932 ± 0.0008 Å
• α: 70.468 ± 0.002°
• β: 74.252 ± 0.002°
• γ: 71.371 ± 0.002°
• Cell volume: 1076.8 ± 0.11 ų
• Cell temperature: 200 ± 1 K
• Ambient diffraction temperature: 200 ± 1 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: 0.0542
• Residual factor for significantly intense reflections: 0.0453
• Weighted residual factors for significantly intense reflections: 0.1248
• Weighted residual factors for all reflections included in the refinement: 0.1323
• Goodness-of-fit parameter for all reflections included in the refinement: 1.036
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No