Quantum chemical calculations and interpretation of electronic transitions and spectroscopic characteristics belonging to 1 3 Mesityl 3 methylcyclobutyl 2 naphthalene 1 yloxy ethanone
Yazarlar (7)
M. Koca
Adiyaman Üniversitesi, Türkiye
Adiyaman Üniversitesi, Türkiye
C. Arici
Hacettepe Üniversitesi, Türkiye
Hacettepe Üniversitesi, Türkiye
Prof. Dr. Halit MUĞLU Kastamonu Üniversitesi, Türkiye
Doç. Dr. Can Doğan VURDU Kastamonu Üniversitesi, Türkiye
Prof. Dr. Fatma Kandemirli Kastamonu Üniversitesi, Türkiye
Y. Zalaoglu
Osmaniye Korkut Ata University, Türkiye
Osmaniye Korkut Ata University, Türkiye
G. Yildirim
Bolu Abant İzzet Baysal Üniversitesi, Türkiye
Bolu Abant İzzet Baysal Üniversitesi, Türkiye
| Makale Türü | Özgün Makale (SSCI, AHCI, SCI, SCI-Exp dergilerinde yayınlanan tam makale) | ||
| Dergi Adı | Spectrochimica Acta Part A Molecular and Biomolecular Spectroscopy | ||
| Dergi ISSN | 1386-1425 Wos Dergi Scopus Dergi | ||
| Dergi Tarandığı Indeksler | SCI | ||
| Makale Dili | İngilizce | Basım Tarihi | 02-2015 |
| Kabul Tarihi | – | Yayınlanma Tarihi | 01-02-2015 |
| Cilt / Sayı / Sayfa | 137 / 1 / 899–912 | DOI | 10.1016/j.saa.2014.08.119 |
| Makale Linki | http://linkinghub.elsevier.com/retrieve/pii/S1386142514013109 | ||
| Özet |
| This comprehensive study reports the synthesis of the title compound, 1-(3-Mesityl-3-methylcyclobutyl)-2-(naphthalene-1-yloxy)ethanone (C26H28O2), and identification of the molecule by means of the standard experimental methods such as single-crystal X-ray diffraction, ultra violet–visible (UV–vis) spectra, Fourier transform infrared (FTIR) spectra, 13C and 1H NMR chemical shifts and quantum chemical calculations using density functional theory (B3LYP) method for the first time. The experimental results observed display that the synthesis of the C26H28O2 compound is perfectly conducted without any impurities. Additionally, the little deviations are noticed on the bond lengths and bond angles, confirming that the strong intra-molecular charge transfers appear in the due to the presence of the electron engagements and conjugative effects (bond weakening). Besides, the intermolecular Csingle bondH⋯O … |
| Anahtar Kelimeler |
| B3LYP | C26H28O2 | FTIR | Identification | NMR | UV-vis |
Science Direct
Quantum chemical calculations and interpretation of electronic transitions and spectroscopic characteristics belonging to 1 3 Mesityl 3 methylcyclobutyl 2 naphthalene 1 yloxy ethanone
BM Sürdürülebilir Kalkınma Amaçları
| Atıf Sayıları | |
| Web of Science | 1 |
| Scopus | 1 |
| Google Scholar | 3 |