Information card for entry 1547259

Structure parameters

• Formula: C23 H24 O6
• Calculated formula: C23 H24 O6
• Title of publication: Structures in solid state and solution of dimethoxy curcuminoids: regioselective bromination and chlorination
• Authors of publication: Petra Galer; Amalija Golobic; Joze Koller; Berta Kosmrlj; Boris Sket
• Journal of publication: Chemistry Central Journal
• Year of publication: 2013
• Journal volume: 7
• Pages of publication: 107
• a: 7.9853 ± 0.0003 Å
• b: 27.0569 ± 0.0008 Å
• c: 19.2058 ± 0.0005 Å
• α: 90°
• β: 101.888 ± 0.003°
• γ: 90°
• Cell volume: 4060.6 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 3
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.1256
• Residual factor for significantly intense reflections: 0.0642
• Weighted residual factors for significantly intense reflections: 0.162
• Weighted residual factors for all reflections included in the refinement: 0.1897
• Goodness-of-fit parameter for all reflections included in the refinement: 1.058
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No