Information card for entry 7211289

Structure parameters

• Formula: C25 H24 N2
• Calculated formula: C25 H24 N2
• SMILES: [nH]1c(nc(c1c1ccccc1)c1ccccc1)c1ccccc1C(C)(C)C
• Title of publication: The formation of peroxide degradation products of photochromic triphenylimidazolyl radical-dimers.
• Authors of publication: Edkins, Robert M.; Probert, Michael R.; Fucke, Katharina; Robertson, Craig M.; Howard, Judith A. K.; Beeby, Andrew
• Journal of publication: Physical chemistry chemical physics : PCCP
• Year of publication: 2013
• Journal volume: 15
• Journal issue: 20
• Pages of publication: 7848 - 7853
• a: 9.692 ± 0.002 Å
• b: 19.705 ± 0.005 Å
• c: 21.494 ± 0.005 Å
• α: 90°
• β: 100.178 ± 0.003°
• γ: 90°
• Cell volume: 4040.3 ± 1.6 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120.15 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 all reflections: 0.0971
• Residual factor for significantly intense reflections: 0.0559
• Weighted residual factors for significantly intense reflections: 0.1293
• Weighted residual factors for all reflections included in the refinement: 0.1471
• Goodness-of-fit parameter for all reflections included in the refinement: 1.001
• Diffraction radiation wavelength: 0.6889 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No