A Close Look at the Molecular Structure, Prototropic Behavior and Supramolecular Architecture of (E)-4-Bromo-2-[(phenylimino)methyl]-5-methoxyphenol by Spectroscopic, Crystallographic, and Computational Methods
Yazarlar (2)
G. Kaştaş
Samsun University, Türkiye
Samsun University, Türkiye
Prof. Dr. Çiğdem ALBAYRAK KAŞTAŞ Sinop Üniversitesi, Türkiye
| Makale Türü |
Özgün Makale
(SSCI, AHCI, SCI, SCI-Exp dergilerinde yayınlanan tam makale)
|
||
| Dergi Adı | Crystallography Reports (Q3) | ||
| Dergi ISSN | 1063-7745 Dergi Bilgileri (2020) | ||
| Dergi Tarandığı Indeksler | SCI-Expanded | ||
| Makale Dili | İngilizce | Basım Tarihi | 05-2020 |
| Kabul Tarihi | 22-04-2019 | Yayınlanma Tarihi | 01-05-2020 |
| Cilt / Sayı / Sayfa | 65 / 3 / 457–462 | DOI | 10.1134/S1063774520030141 |
| Makale Linki | http://link.springer.com/10.1134/S1063774520030141 | ||
| UAK Araştırma Alanları |
Organik Kimya
|
||
| Özet |
| In this study, the molecular structure, prototropic behavior and supramolecular architecture of a new Schiff base have been studied in depth using spectroscopic (UV-vis), crystallographic (XRD) and computational (HOMA and DFT) methods. Regarding the molecular structure and prototropy, the XRD, DFT and HOMA results show that the compound exists in phenol-imine form. The HOMA indices for the structural evaluation show that the compound has a pure aromatic structure in solid state. UV-vis spectra of the compound dissolved in four different solvents were investigated in order to determine which tautomeric form of the compound is dominant in the solution. It is found that the compound prefers only phenol-imine form in apolar solvents while both phenol-imine and keto amine forms appear in polar solvents. This is because polar solvent decrease the activation energy, and thus, it becomes possible to observe … |
| Anahtar Kelimeler |
BM Sürdürülebilir Kalkınma Amaçları
| Atıf Sayıları | |
| Web of Science | 2 |
| Scopus | 2 |
| Google Scholar | 2 |