Information card for entry 2206986

Structure parameters

• Chemical name: 6-Phenyl-5,6-dihydrobenzoimidazo[1,2-c]quinazoline
• Formula: C20 H15 N3
• Calculated formula: C20 H15 N3
• SMILES: n12c3ccccc3nc1c1c(NC2c2ccccc2)cccc1
• Title of publication: 6-Phenyl-5,6-dihydrobenzoimidazo[1,2-<i>c</i>]quinazoline
• Authors of publication: Mahendra, M; Gayathri, V.; Jayalakshmi, K.; Rangappa, K. S.; Sridhar, M. A.; Shashidhara Prasad, J.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2005
• Journal volume: 61
• Journal issue: 10
• Pages of publication: o3249 - o3251
• a: 11.569 ± 0.0008 Å
• b: 9.915 ± 0.0007 Å
• c: 14.337 ± 0.001 Å
• α: 90°
• β: 114.086 ± 0.004°
• γ: 90°
• Cell volume: 1501.36 ± 0.19 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 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: 0.0573
• Residual factor for significantly intense reflections: 0.0465
• Weighted residual factors for significantly intense reflections: 0.1224
• Weighted residual factors for all reflections included in the refinement: 0.1437
• Goodness-of-fit parameter for all reflections included in the refinement: 1.182
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes