Information card for entry 1514875

Structure parameters

• Formula: C36 H27 N7
• Calculated formula: C36 H27 N7
• SMILES: N(c1ccc(cc1)N=Nc1ccccc1)(c1ccc(cc1)N=Nc1ccccc1)c1ccc(cc1)N=Nc1ccccc1
• Title of publication: Photochemical properties of multi-azobenzene compounds.
• Authors of publication: Bahrenburg, Julia; Sievers, Claudia M.; Schönborn, Jan Boyke; Hartke, Bernd; Renth, Falk; Temps, Friedrich; Näther, Christian; Sönnichsen, Frank D
• Journal of publication: Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology
• Year of publication: 2013
• Journal volume: 12
• Journal issue: 3
• Pages of publication: 511 - 518
• a: 9.807 ± 0.002 Å
• b: 10.079 ± 0.002 Å
• c: 29.603 ± 0.006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2926.1 ± 1 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 3
• 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: 0.0464
• Residual factor for significantly intense reflections: 0.0337
• Weighted residual factors for significantly intense reflections: 0.0782
• Weighted residual factors for all reflections included in the refinement: 0.0838
• Goodness-of-fit parameter for all reflections included in the refinement: 1.018
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No