Information card for entry 7214759

Structure parameters

• Formula: C42 H56 N2 O4
• Calculated formula: C42 H56 N2 O4
• Title of publication: Alkyl and diether bridged N,N,N′,N′-tetra(2-hydroxybenzyl)diamines: effects of hydrogen bonding on structure and solubility
• Authors of publication: Riisiö, Antti; Hänninen, Mikko M.; Sillanpää, Reijo
• Journal of publication: CrystEngComm
• Year of publication: 2012
• Journal volume: 14
• Journal issue: 21
• Pages of publication: 7258
• a: 10.3558 ± 0.0005 Å
• b: 26.56 ± 0.0014 Å
• c: 14.0029 ± 0.0007 Å
• α: 90°
• β: 107.368 ± 0.003°
• γ: 90°
• Cell volume: 3675.9 ± 0.3 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 4
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0658
• Residual factor for significantly intense reflections: 0.0523
• Weighted residual factors for significantly intense reflections: 0.1347
• Weighted residual factors for all reflections included in the refinement: 0.1454
• Goodness-of-fit parameter for all reflections included in the refinement: 1.055
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No