Information card for entry 2208952

Structure parameters

• Chemical name: N,N'-Octamethylenebis(4-methylbenzamide)
• Formula: C24 H32 N2 O2
• Calculated formula: C24 H32 N2 O2
• SMILES: O=C(c1ccc(cc1)C)NCCCCCCCCNC(=O)c1ccc(cc1)C
• Title of publication: <i>N</i>,<i>N</i>'-Octamethylenebis(4-methylbenzamide)
• Authors of publication: Awaleh, Mohamed Osman; Badia, Antonnella; Brisse, François
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 5
• Pages of publication: o1996 - o1997
• a: 7.119 ± 0.0002 Å
• b: 5.1609 ± 0.0002 Å
• c: 28.4022 ± 0.001 Å
• α: 90°
• β: 96.679 ± 0.002°
• γ: 90°
• Cell volume: 1036.43 ± 0.06 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0801
• Residual factor for significantly intense reflections: 0.054
• Weighted residual factors for significantly intense reflections: 0.1411
• Weighted residual factors for all reflections included in the refinement: 0.1655
• Goodness-of-fit parameter for all reflections included in the refinement: 1.035
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No