Crystal structure and theoretical study of (2E)-1-[4-hydroxy-3-(morpholin-4-ylmethyl)phenyl]-3-(thiophen-2-yl)prop-2-en-1-one
Yazarlar (5)
Öğr. Gör. Fatma Yesilyurt Atatürk Üniversitesi, Türkiye
Prof. Dr. Abdullah AYDIN Kastamonu Üniversitesi, Türkiye
Prof. Dr. Halise Inci Gul Atatürk Üniversitesi, Türkiye
Mehmet Akkurt Erciyes Üniversitesi, Türkiye
Nefise Dilek Ozcelik
Aksaray Üniversitesi, Türkiye
Aksaray 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 | 06-2018 |
| Kabul Tarihi | 08-06-2018 | Yayınlanma Tarihi | 12-06-2018 |
| Cilt / Sayı / Sayfa | 74 / 1 / 960–963 | DOI | 10.1107/S2056989018008459 |
| Makale Linki | http://dx.doi.org/10.1107/s2056989018008459 | ||
| UAK Araştırma Alanları |
Fen Bilgisi Eğitimi
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| Özet |
| In the title compound, C18H19NO3S, the morpholine ring adopts a chair conformation. The thiophene ring forms dihedral angles of 26.04 (9) and 74.07 (10)° with the benzene ring and the mean plane of the morpholine ring, respectively. The molecular conformation is stabilized by an O—H⋯N hydrogen bond. In the crystal, molecules are connected through C—H⋯O hydrogen bonds, forming wave-like layers parallel to the ab plane, which are further linked into a three-dimensional network by C—H⋯π interactions involving the benzene rings and the methylene H atoms of the morpholine rings. |
| Anahtar Kelimeler |
| chalcones | Crystal structure | HOMO | LUMO | Mannich bases | quantum-chemical calculation | theoretical study |
Science Direct
Crystal structure and theoretical study of (2E)-1-[4-hydroxy-3-(morpholin-4-ylmethyl)phenyl]-3-(thiophen-2-yl)prop-2-en-1-one
BM Sürdürülebilir Kalkınma Amaçları
| Atıf Sayıları | |
| Web of Science | 3 |
| Scopus | 3 |
| Google Scholar | 3 |