Information card for entry 2215927

Structure parameters

• Chemical name: 3-[4-(Dimethylamino)benzylideneamino]-2-methylquinazolin-4(3H)-one
• Formula: C18 H18 N4 O
• Calculated formula: C18 H18 N4 O
• SMILES: c1c2c(ccc1)nc(C)n(c2=O)\N=C\c1ccc(cc1)N(C)C
• Title of publication: 3-[4-(Dimethylamino)benzylideneamino]-2-methylquinazolin-4(3<i>H</i>)-one
• Authors of publication: Kumaradhas, P.; Sankara Lakshmi, G.; Sridhar, B.; Paneer Selvam, P.; Saravanan, G.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 11
• Pages of publication: o4293 - o4293
• a: 7.5175 ± 0.001 Å
• b: 9.3631 ± 0.0013 Å
• c: 12.7886 ± 0.0017 Å
• α: 98.198 ± 0.002°
• β: 103.259 ± 0.002°
• γ: 112.517 ± 0.002°
• Cell volume: 782.33 ± 0.18 ų
• Cell temperature: 296 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for significantly intense reflections: 0.0491
• Weighted residual factors for all reflections included in the refinement: 0.1495
• Goodness-of-fit parameter for all reflections included in the refinement: 1.029
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes