Crystallographic and Conformational Analysis of Z 2 ethoxy 6 2 hydroxyphenyl amino methylene cyclohexa 2 4 dienone
Yazarlar (5)
Hande Petek
Ondokuz Mayis Üniversitesi, Türkiye
Ondokuz Mayis Üniversitesi, Türkiye
Prof. Dr. Çiğdem ALBAYRAK KAŞTAŞ Ondokuz Mayis Üniversitesi, Türkiye
Mustafa Odabaşoǧlu
Ondokuz Mayis Üniversitesi, Türkiye
Ondokuz Mayis Üniversitesi, Türkiye
Ismet Şenel
Ondokuz Mayis Üniversitesi, Türkiye
Ondokuz Mayis Üniversitesi, Türkiye
Orhan Büyükgüngör
Ondokuz Mayis Üniversitesi, Türkiye
Ondokuz Mayis Üniversitesi, Türkiye
| Makale Türü |
Özgün Makale
(SSCI, AHCI, SCI, SCI-Exp dergilerinde yayınlanan tam makale)
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| Dergi Adı | Journal of Chemical Crystallography (Q4) | ||
| Dergi ISSN | 1074-1542 Dergi Bilgileri (2008) | ||
| Dergi Tarandığı Indeksler | SCI-Expanded | ||
| Makale Dili | İngilizce | Basım Tarihi | 12-2008 |
| Kabul Tarihi | – | Yayınlanma Tarihi | 30-05-2008 |
| Cilt / Sayı / Sayfa | 38 / 12 / 901–905 | DOI | 10.1007/s10870-008-9402-2 |
| Makale Linki | http://link.springer.com/10.1007/s10870-008-9402-2 | ||
| UAK Araştırma Alanları |
Organik Kimya
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| Özet |
| The single crystal X-ray diffraction analysis of the title compound, C15H15NO3, shows that the structure is adopted to its NH tautomeric form and crystallizes in the orthorhombic space group P bcn with a = 21.2424(15) Å, b = 12.7696(9) Å, c = 9.3605(10) Å, Z = 8, V = 2539.1(4) Å3, Dc = 1.346 g/cm3. The molecular conformation in the crystal is stabilized by an intramolecular H-bond and the crystal structure is stabilized by the bifurcated O–H···O type intermolecular H-bonds. In order to understand the effects on conformational flexibility of the title molecule, molecular energy profile was calculated as a function of the selected torsion angle by means of AM1 semi-empirical method.Index AbstractMolecular and crystal structure of [(Z)-2-ethoxy-6-[(2-hydroxyphenylamino)methylene]cyclohexa-2,4-dienone], C15H15NO3, have been determined by single crystal X-ray diffraction study, and conformational analysis of the title … |
| Anahtar Kelimeler |
| AM1 | Bifurcated hydrogen bond | Conformational analysis | Crystal structure | Schiff base |
BM Sürdürülebilir Kalkınma Amaçları
| Atıf Sayıları | |
| Web of Science | 20 |
| Scopus | 21 |
| Google Scholar | 24 |