Information card for entry 1520507

Structure parameters

• Formula: C42 H86 N4 O6
• Calculated formula: C42 H86 N4 O6
• SMILES: O=C([O-])CCC(=O)NCCCCCCNC(=O)CCC(=O)[O-].[NH3+]CCCCCCCCCCCCCC.[NH3+]CCCCCCCCCCCCCC
• Title of publication: Heat-set gels formed from easily accessible gelators of a succinamic acid derivative (SAD) and a primary alkyl amine (R-NH2).
• Authors of publication: Zhong, Di-Chang; Liao, Lie-Qiang; Wang, Ke-Jun; Liu, Hui-Jin; Luo, Xu-Zhong
• Journal of publication: Soft matter
• Year of publication: 2015
• Journal volume: 11
• Journal issue: 32
• Pages of publication: 6386 - 6392
• a: 4.7746 ± 0.0003 Å
• b: 5.4698 ± 0.0003 Å
• c: 44.772 ± 0.003 Å
• α: 91.162 ± 0.005°
• β: 91.821 ± 0.005°
• γ: 96.985 ± 0.005°
• Cell volume: 1159.66 ± 0.12 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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: 0.1219
• Residual factor for significantly intense reflections: 0.083
• Weighted residual factors for significantly intense reflections: 0.2115
• Weighted residual factors for all reflections included in the refinement: 0.2365
• Goodness-of-fit parameter for all reflections included in the refinement: 1.043
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No