Information card for entry 2240594

Structure parameters

• Chemical name: Bis(4-methoxyphenyl) malonate
• Formula: C17 H16 O6
• Calculated formula: C17 H16 O6
• Title of publication: Crystal structure of bis(4-methoxyphenyl) malonate
• Authors of publication: Devarajegowda, H. C.; Suchetan, P. A.; Sreenivasa, S.; Srinivasa, H. T.; Palakshamurthy, B. S.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2015
• Journal volume: 71
• Journal issue: 5
• Pages of publication: o330 - o331
• a: 5.4307 ± 0.0019 Å
• b: 8.131 ± 0.003 Å
• c: 36.149 ± 0.01 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1596.2 ± 0.9 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 3
• Space group number: 60
• Hermann-Mauguin space group symbol: P b c n
• Hall space group symbol: -P 2n 2ab
• Residual factor for all reflections: 0.0699
• Residual factor for significantly intense reflections: 0.0407
• Weighted residual factors for significantly intense reflections: 0.1341
• Weighted residual factors for all reflections included in the refinement: 0.1616
• Goodness-of-fit parameter for all reflections included in the refinement: 1.031
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes