Information card for entry 4507018

Structure parameters

• Formula: C34 H52 N4 O4
• Calculated formula: C34 H38 N4 O4
• Title of publication: Secondary Ammonium Dicarboxylate (SAD)—A Supramolecular Synthon in Designing Low Molecular Weight Gelators Derived from Azo-Dicarboxylates
• Authors of publication: Sahoo, Pathik; Dastidar, Parthasarathi
• Journal of publication: Crystal Growth & Design
• Year of publication: 2012
• Journal volume: 12
• Journal issue: 12
• Pages of publication: 5917
• a: 8.1405 ± 0.0013 Å
• b: 11.1094 ± 0.0018 Å
• c: 11.6064 ± 0.0019 Å
• α: 108.919 ± 0.003°
• β: 109.462 ± 0.003°
• γ: 101.428 ± 0.004°
• Cell volume: 879.3 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.1909
• Residual factor for significantly intense reflections: 0.1536
• Weighted residual factors for significantly intense reflections: 0.383
• Weighted residual factors for all reflections included in the refinement: 0.4161
• Goodness-of-fit parameter for all reflections included in the refinement: 1.208
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No