Information card for entry 2211996

Structure parameters

• Chemical name: 6,6'-Dimethoxy-2,2'-(2,2,4-trimethylimidazolidine-1,3- dimethyldimethylene)diphenol
• Formula: C22 H30 N2 O4
• Calculated formula: C22 H30 N2 O4
• SMILES: COc1cccc(c1O)CN1CC(N(C1(C)C)Cc1cccc(c1O)OC)C
• Title of publication: 6,6'-Dimethoxy-2,2'-(2,2,4-trimethylimidazolidine-1,3-diyldimethylene)diphenol
• Authors of publication: Xia, H.-T.; Liu, Y.-F.; Yang, S.-P.; Wang, D.-Q.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 2
• Pages of publication: o680 - o682
• a: 9.879 ± 0.002 Å
• b: 10.443 ± 0.002 Å
• c: 10.941 ± 0.003 Å
• α: 68.26 ± 0.003°
• β: 85.659 ± 0.003°
• γ: 84.541 ± 0.004°
• Cell volume: 1042.7 ± 0.4 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1375
• Residual factor for significantly intense reflections: 0.0549
• Weighted residual factors for significantly intense reflections: 0.108
• Weighted residual factors for all reflections included in the refinement: 0.1375
• Goodness-of-fit parameter for all reflections included in the refinement: 0.95
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes