Information card for entry 1557368

Structure parameters

• Chemical name: 1,4-Bis(4-methoxyphenyl)naphthalene
• Formula: C24 H20 O2
• Calculated formula: C24 H20 O2
• SMILES: c1cccc2c(ccc(c12)c1ccc(cc1)OC)c1ccc(cc1)OC
• Title of publication: 1,4-Bis(4-methoxyphenyl)naphthalene
• Authors of publication: Manickam, R.; Jagadeesan, G.; Karunakaran, J.; Srinivasan, G.
• Journal of publication: IUCrData
• Year of publication: 2020
• Journal volume: 5
• Journal issue: 2
• Pages of publication: x200212
• a: 21.55 ± 0.0008 Å
• b: 6.0366 ± 0.0002 Å
• c: 27.4915 ± 0.0009 Å
• α: 90°
• β: 92.111 ± 0.001°
• γ: 90°
• Cell volume: 3573.9 ± 0.2 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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: 0.1554
• Residual factor for significantly intense reflections: 0.0773
• Weighted residual factors for significantly intense reflections: 0.1995
• Weighted residual factors for all reflections included in the refinement: 0.2814
• Goodness-of-fit parameter for all reflections included in the refinement: 1.019
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes