Information card for entry 7222379

Structure parameters

• Chemical name: bis-(4-methoxyphenyl)-amine
• Formula: C14 H15 N O2
• Calculated formula: C14 H15 N O2
• SMILES: c1(ccc(cc1)OC)Nc1ccc(cc1)OC
• Title of publication: Direct metal-free synthesis of diarylamines from 2-nitropropane via the twofold C-H functionalization of arenes
• Authors of publication: Aksenov, Alexander V.; Aksenov, Nicolai A.; Orazova, Naila A.; Aksenov, Dmitrii A.; Dmitriev, Maksim V.; Rubin, Michael
• Journal of publication: RSC Adv.
• Year of publication: 2015
• a: 6.1451 ± 0.0001 Å
• b: 26.7789 ± 0.0005 Å
• c: 7.392 ± 0.0001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1216.42 ± 0.03 ų
• Cell temperature: 292.89 ± 0.11 K
• Ambient diffraction temperature: 292.89 ± 0.11 K
• Number of distinct elements: 4
• Space group number: 41
• Hermann-Mauguin space group symbol: C 2 c b
• Hall space group symbol: C -2ac 2
• Residual factor for all reflections: 0.0315
• Residual factor for significantly intense reflections: 0.0311
• Weighted residual factors for significantly intense reflections: 0.09
• Weighted residual factors for all reflections included in the refinement: 0.0904
• Goodness-of-fit parameter for all reflections included in the refinement: 1.108
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No