Information card for entry 3500105

Structure parameters

• Common name: 3,5-dimethoxyphenol
• Chemical name: 3,5-dimethoxyphenol
• Formula: C8 H10 O3
• Calculated formula: C8 H10 O3
• Authors of publication: Thierry Maris
• Journal of publication: Personal communication to COD
• Year of publication: 2020
• a: 13.5504 ± 0.0004 Å
• b: 7.5443 ± 0.0002 Å
• c: 14.8005 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1513.03 ± 0.08 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 3
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0347
• Residual factor for significantly intense reflections: 0.0338
• Weighted residual factors for significantly intense reflections: 0.0929
• Weighted residual factors for all reflections included in the refinement: 0.0941
• Goodness-of-fit parameter for all reflections included in the refinement: 1.067
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.34139 Å
• Diffraction radiation type: GaKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes