Information card for entry 7050017

Structure parameters

• Formula: C26 H25 N3 O2
• Calculated formula: C26 H25 N3 O2
• Title of publication: Heterocyclic quinol-type fluorophores: Synthesis of novel imidazoanthraquinol derivatives and their photophysical properties in benzene and in the crystalline state
• Authors of publication: K.Yoshida; N.Takato; O.Yousuke
• Journal of publication: New J.Chem.(Nouv.J.Chim.)
• Year of publication: 2005
• Journal volume: 29
• Journal issue: 9
• Pages of publication: 1204
• a: 11.111 ± 0.002 Å
• b: 16.954 ± 0.002 Å
• c: 12.318 ± 0.002 Å
• α: 90°
• β: 113.97 ± 0.01°
• γ: 90°
• Cell volume: 2120.3 ± 0.5 ų
• Cell temperature: 296.2 K
• Number of distinct elements: 4
• 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: 0.0994
• Residual factor for significantly intense reflections: 0.0623
• Weighted residual factors for significantly intense reflections: 0.1457
• Weighted residual factors for all reflections included in the refinement: 0.1662
• Goodness-of-fit parameter for all reflections included in the refinement: 1.444
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Duplicate of: 7050024
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No