Information card for entry 2241337

Structure parameters

• Chemical name: 5-(5,6-Dihydrobenzo[4,5]imidazo[1,2-<i>c</i>]quinazolin-6-yl)-2-methoxyphenol
• Formula: C21 H17 N3 O2
• Calculated formula: C21 H17 N3 O2
• Title of publication: Crystal structure of 5-(5,6-dihydrobenzo[4,5]imidazo[1,2-<i>c</i>]quinazolin-6-yl)-2-methoxyphenol
• Authors of publication: Adam, Farook; Arafath, Md. Azharul; Rosenani, A. Haque; Razali, Mohd. R.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2015
• Journal volume: 71
• Journal issue: 12
• Pages of publication: o971 - o972
• a: 9.7359 ± 0.0007 Å
• b: 10.0822 ± 0.0007 Å
• c: 17.4624 ± 0.0013 Å
• α: 90°
• β: 94.2958 ± 0.0015°
• γ: 90°
• Cell volume: 1709.3 ± 0.2 ų
• Cell temperature: 294 ± 2 K
• Ambient diffraction temperature: 294 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0717
• Residual factor for significantly intense reflections: 0.049
• Weighted residual factors for significantly intense reflections: 0.1248
• Weighted residual factors for all reflections included in the refinement: 0.1394
• Goodness-of-fit parameter for all reflections included in the refinement: 1.046
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes