Information card for entry 2243416

Structure parameters

• Chemical name: 4-(Naphthalen-2-yl)-<i>N</i>-[(<i>Z</i>)-4-propoxybenzylidene]-1,3-thiazol-2-amine
• Formula: C23 H20 N2 O S
• Calculated formula: C23 H20 N2 O S
• SMILES: s1c(nc(c2cc3c(cc2)cccc3)c1)/N=C/c1ccc(OCCC)cc1
• Title of publication: Crystal structure and Hirshfeld surface analysis of 4-(naphthalen-2-yl)-<i>N</i>-[(<i>Z</i>)-4-propoxybenzylidene]-1,3-thiazol-2-amine
• Authors of publication: Sheakh Mohamad, Ropak A.; Hamad, Wali M.; Aziz, Hashim J.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2020
• Journal volume: 76
• Journal issue: 6
• Pages of publication: 920 - 923
• a: 19.1636 ± 0.0011 Å
• b: 6.0482 ± 0.0003 Å
• c: 17.023 ± 0.001 Å
• α: 90°
• β: 104.37 ± 0.005°
• γ: 90°
• Cell volume: 1911.33 ± 0.19 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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: 0.1308
• Residual factor for significantly intense reflections: 0.0555
• Weighted residual factors for significantly intense reflections: 0.0725
• Weighted residual factors for all reflections included in the refinement: 0.0872
• Goodness-of-fit parameter for all reflections included in the refinement: 0.956
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes