Crystal structure and Hirshfeld surface analysis of 2-[(1,3-benzoxazol-2-yl)sulfanyl]-N-(2-methoxyphenyl)acetamide
Yazarlar (5)
Prof. Dr. Abdullah AYDIN Kastamonu Üniversitesi, Türkiye
Doç. Dr. Sevim Turktekin Celikesir Erciyes Üniversitesi, Türkiye
Dr. Öğr. Üyesi Mehmet Akkurt Erciyes Üniversitesi, Türkiye
Dr. Öğr. Üyesi Merve Saylam İzmir Kâtip Çelebi Üniversitesi, Türkiye
Varol Pabuccuoglu
Ege Üniversitesi, Türkiye
Ege Üniversitesi, Türkiye
| Makale Türü |
Özgün Makale
(ESCI dergilerinde yayınlanan tam makale)
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| Dergi Adı | Acta Crystallographica Section E Crystallographic Communications | ||
| Dergi ISSN | 2056-9890 Wos Dergi Scopus Dergi | ||
| Dergi Tarandığı Indeksler | ESCI | ||
| Makale Dili | İngilizce | Basım Tarihi | 09-2019 |
| Kabul Tarihi | 18-09-2019 | Yayınlanma Tarihi | 27-09-2019 |
| Cilt / Sayı / Sayfa | 75 / 1 / 1531–1535 | DOI | 10.1107/S2056989019012908 |
| Makale Linki | http://dx.doi.org/10.1107/s2056989019012908 | ||
| UAK Araştırma Alanları |
Fen Bilgisi Eğitimi
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| Özet |
| In the title compound, C16H14N2O3S, the 1,3-benzoxazole ring system is essentially planar (r.m.s deviation = 0.004 Å) and makes a dihedral angle of 66.16 (17)° with the benzene ring of the methoxyphenyl group. Two intramolecular N—H⋯O and N—H⋯N hydrogen bonds occur, forming S(5) and S(7) ring motifs, respectively. In the crystal, pairs of C—H⋯O hydrogen bonds link the molecules into inversion dimers with R22(14) ring motifs, stacked along the b-axis direction. The inversion dimers are linked by C—H⋯π and π–π-stacking interactions [centroid-to-centroid distances = 3.631 (2) and 3.631 (2) Å], forming a three-dimensional network. Two-dimensional fingerprint plots associated with the Hirshfeld surface show that the largest contributions to the crystal packing come from H⋯H (39.3%), C⋯H/H⋯C (18.0%), O⋯H/H⋯O (15.6) and S⋯H/H⋯S (10.2%) interactions. |
| Anahtar Kelimeler |
| 1,3-benzoxazole ring system | Crystal structure | Dimers | Hirshfeld surface analysis | Hydrogen bonding |
Science Direct
Crystal structure and Hirshfeld surface analysis of 2-[(1,3-benzoxazol-2-yl)sulfanyl]-N-(2-methoxyphenyl)acetamide
BM Sürdürülebilir Kalkınma Amaçları
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| Google Scholar | 1 |