Information card for entry 2214479

Structure parameters

• Chemical name: 6,6'-Dimethoxy-2,2'-(o-phenylenediimino)diphenol
• Formula: C22 H24 N2 O4
• Calculated formula: C22 H24 N2 O4
• SMILES: N(c1c(NCc2c(O)c(OC)ccc2)cccc1)Cc1c(O)c(OC)ccc1
• Title of publication: 6,6'-Dimethoxy-2,2'-(<i>o</i>-phenylenediimino)diphenol
• Authors of publication: Liu, Y.-F.; Xia, H.-T.; Yang, S.-P.; Wang, D.-Q.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 8
• Pages of publication: o3562 - o3562
• a: 10.4331 ± 0.0014 Å
• b: 15.7674 ± 0.0016 Å
• c: 23.398 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3849 ± 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: 0.1271
• Residual factor for significantly intense reflections: 0.0465
• Weighted residual factors for significantly intense reflections: 0.079
• Weighted residual factors for all reflections included in the refinement: 0.0961
• Goodness-of-fit parameter for all reflections included in the refinement: 0.811
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes