Information card for entry 1518200

Structure parameters

• Formula: C28 H20 N4
• Calculated formula: C28 H20 N4
• SMILES: N(=Nc1ccccc1)c1c(c(N=Nc2ccccc2)ccc1)c1cccc2ccccc12
• Title of publication: Dynamic induction of enantiomeric excess from a prochiral azobenzene dimer under circularly polarized light
• Authors of publication: Rijeesh, K.; Hashim, P. K.; Noro, Shin-ichiro; Tamaoki, Nobuyuki
• Journal of publication: Chem. Sci.
• Year of publication: 2015
• Journal volume: 6
• Journal issue: 2
• Pages of publication: 973
• a: 7.8497 ± 0.0005 Å
• b: 10.7861 ± 0.0008 Å
• c: 14.7876 ± 0.001 Å
• α: 109.56 ± 0.003°
• β: 91.8983 ± 0.0018°
• γ: 111.312 ± 0.003°
• Cell volume: 1081.87 ± 0.13 ų
• Cell temperature: 173 K
• Ambient diffraction temperature: 173 K
• Number of distinct elements: 3
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for significantly intense reflections: 0.0503
• Weighted residual factors for all reflections included in the refinement: 0.1454
• Goodness-of-fit parameter for all reflections included in the refinement: 1.065
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No