Information card for entry 7114504

Structure parameters

• Formula: C23 H28 N2 O4
• Calculated formula: C23 H28 N2 O4
• SMILES: O1[C@H](C[C@H](OC1=O)CCCCCC)c1ccc(N=Nc2ccc(OC)cc2)cc1
• Title of publication: A rodlike organogelator: fibrous aggregation of azobenzene derivatives with a syn-chiral carbonate moietyElectronic supplementary information (ESI) available: synthetic scheme for (R,R)-2; FT-IR and SAXS measurements of (R,R)-(+)-1. See http://www.rsc.org/suppdata/cc/b2/b205072b/
• Authors of publication: Mamiya, Jun-ichi; Kanie, Kiyoshi; Hiyama, Tamejiro; Ikeda, Tomiki; Kato, Takashi
• Journal of publication: Chemical Communications
• Year of publication: 2002
• Journal issue: 17
• Pages of publication: 1870
• a: 5.853 ± 0.0002 Å
• b: 9.381 ± 0.0005 Å
• c: 40.728 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2236.3 ± 0.2 ų
• Cell temperature: 298 K
• Number of distinct elements: 4
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.095
• Weighted residual factors for all reflections: 0.126
• Weighted residual factors for all reflections included in the refinement: 0.126
• Goodness-of-fit parameter for all reflections: 0.902
• Goodness-of-fit parameter for all reflections included in the refinement: 0.949
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No