Information card for entry 1519690

Structure parameters

• Formula: C26 H19 N
• Calculated formula: C26 H18 N
• SMILES: N(c1c2ccccc2cc2ccccc12)(c1ccccc1)c1ccccc1
• Title of publication: Directional Control of π-Conjugation Enabled by Distortion of the Donor Plane in Diarylaminoanthracenes: A Photophysical Study.
• Authors of publication: Sasaki, Shunsuke; Hattori, Kengo; Igawa, Kazunobu; Konishi, Gen-Ichi
• Journal of publication: The journal of physical chemistry. A
• Year of publication: 2015
• Journal volume: 119
• Journal issue: 20
• Pages of publication: 4898 - 4906
• a: 12.939 ± 0.003 Å
• b: 8.692 ± 0.002 Å
• c: 16.454 ± 0.004 Å
• α: 90°
• β: 105.933 ± 0.016°
• γ: 90°
• Cell volume: 1779.4 ± 0.7 ų
• Cell temperature: 123 K
• Ambient diffraction temperature: 123 K
• Number of distinct elements: 3
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for significantly intense reflections: 0.0463
• Weighted residual factors for all reflections included in the refinement: 0.1073
• Goodness-of-fit parameter for all reflections included in the refinement: 1
• Diffraction radiation wavelength: 1.54187 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No