Information card for entry 4107972

Structure parameters

• Formula: C26 H23 N O2
• Calculated formula: C26 H23 N O2
• SMILES: C1CCC(CC1)N1C(=O)[C@H]2[C@@H](C1=O)[C@@H]1[C@H]2c2c3C(=C1)c1c(c3ccc2)cccc1
• Title of publication: Asymmetric [2 + 2] Olefin Cross Photoaddition in a Self-Assembled Host with Remote Chiral Auxiliaries
• Authors of publication: Yuki Nishioka; Takumi Yamaguchi; Masaki Kawano; Makoto Fujita
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2008
• Journal volume: 130
• Pages of publication: 8160 - 8161
• a: 19.2325 ± 0.0004 Å
• b: 9.97896 ± 0.00018 Å
• c: 31.6956 ± 0.0006 Å
• α: 90°
• β: 106.072 ± 0.0007°
• γ: 90°
• Cell volume: 5845.3 ± 0.2 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 4
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0569
• Residual factor for significantly intense reflections: 0.0384
• Weighted residual factors for significantly intense reflections: 0.0828
• Weighted residual factors for all reflections included in the refinement: 0.0998
• Goodness-of-fit parameter for all reflections included in the refinement: 1.064
• Diffraction radiation wavelength: 1.54186 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No