Information card for entry 2235847

Structure parameters

• Chemical name: 2-(Naphthalen-1-yl)-<i>N</i>-(1,3-thiazol-2-yl)acetamide
• Formula: C15 H12 N2 O S
• Calculated formula: C15 H12 N2 O S
• SMILES: s1ccnc1NC(=O)Cc1cccc2ccccc12
• Title of publication: 2-(Naphthalen-1-yl)-<i>N</i>-(1,3-thiazol-2-yl)acetamide
• Authors of publication: Fun, Hoong-Kun; Quah, Ching Kheng; Nayak, Prakash S.; Narayana, B.; Sarojini, B. K.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 8
• Pages of publication: o2464
• a: 5.2668 ± 0.0001 Å
• b: 13.0861 ± 0.0002 Å
• c: 18.5373 ± 0.0003 Å
• α: 90°
• β: 105.64 ± 0.001°
• γ: 90°
• Cell volume: 1230.32 ± 0.04 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 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: 0.0611
• Residual factor for significantly intense reflections: 0.0467
• Weighted residual factors for significantly intense reflections: 0.1003
• Weighted residual factors for all reflections included in the refinement: 0.1075
• Goodness-of-fit parameter for all reflections included in the refinement: 1.056
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes