Information card for entry 2014824

Structure parameters

• Common name: 2-(Acridin-9-ylimino)-3-(dimethylamino)-1,3-thiazolidin-4-one
• Chemical name: 2-(Acridin-9-ylimino)-3-dimethylamino-1,3-thiazolidin-4-one
• Formula: C18 H16 N4 O S
• Calculated formula: C18 H16 N4 O S
• SMILES: S1C(=Nc2c3ccccc3nc3ccccc23)N(N(C)C)C(=O)C1
• Title of publication: 2-(Acridin-9-ylimino)-3-dimethylamino-1,3-thiazolidin-4-one
• Authors of publication: Ján Imrich; Mária Vilková; Juraj Černák
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2005
• Journal volume: 61
• Journal issue: 4
• Pages of publication: o231 - o233
• a: 7.282 ± 0.005 Å
• b: 19.456 ± 0.005 Å
• c: 11.954 ± 0.005 Å
• α: 90°
• β: 105.326 ± 0.005°
• γ: 90°
• Cell volume: 1633.4 ± 1.4 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 5
• 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: 0.0728
• Residual factor for significantly intense reflections: 0.0353
• Weighted residual factors for significantly intense reflections: 0.0693
• Weighted residual factors for all reflections included in the refinement: 0.0785
• Goodness-of-fit parameter for all reflections included in the refinement: 0.871
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes