Information card for entry 2102971

Structure parameters

• Formula: C24 H31 N O3
• Calculated formula: C24 H30.274 N O3
• Title of publication: Monitoring structural transformations in crystals. 11. Yang photocyclizations ‒ one type of reaction, but diversity of structural changes
• Authors of publication: Turowska-Tyrk, Ilona; Bakowicz, Julia; Scheffer, John R.
• Journal of publication: Acta Crystallographica Section B
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 6
• Pages of publication: 933 - 940
• a: 6.8632 ± 0.0008 Å
• b: 11.9445 ± 0.0017 Å
• c: 26.305 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2156.4 ± 0.5 ų
• Cell temperature: 299 ± 2 K
• Ambient diffraction temperature: 299 ± 2 K
• Number of distinct elements: 4
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.1407
• Residual factor for significantly intense reflections: 0.0676
• Weighted residual factors for significantly intense reflections: 0.1804
• Weighted residual factors for all reflections included in the refinement: 0.212
• Goodness-of-fit parameter for all reflections included in the refinement: 0.958
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes