Information card for entry 2220448

Structure parameters

• Chemical name: (<i>E</i>)-<i>N</i>-(2,3,4-Trimethoxy-6-methylbenzylidene)naphthalen-1-amine
• Formula: C21 H21 N O3
• Calculated formula: C21 H21 N O3
• SMILES: N(=C\c1c(OC)c(OC)c(OC)cc1C)/c1cccc2c1cccc2
• Title of publication: (<i>E</i>)-<i>N</i>-(2,3,4-Trimethoxy-6-methylbenzylidene)naphthalen-1-amine
• Authors of publication: Wang, Cheng-Yun
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 1
• Pages of publication: o56
• a: 10.9225 ± 0.0014 Å
• b: 14.763 ± 0.0016 Å
• c: 22.514 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3630.4 ± 0.7 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 4
• 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: 0.1041
• Residual factor for significantly intense reflections: 0.059
• Weighted residual factors for significantly intense reflections: 0.1469
• Weighted residual factors for all reflections included in the refinement: 0.1658
• Goodness-of-fit parameter for all reflections included in the refinement: 1.066
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes