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Sert, Yusuf, Balakit, Asim A., Öztürk, Nuri, Ucun, Fatih, El-Hiti, Gamal A. (2014) Experimental (FT-IR, NMR and UV) and theoretical (M06-2X and DFT) investigation, and frequency estimation analyses on (E)-3-(4-bromo-5-methylthiophen-2-yl)acrylonitrile. Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 131. 502-511 doi:10.1016/j.saa.2014.04.105

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Reference TypeJournal (article/letter/editorial)
TitleExperimental (FT-IR, NMR and UV) and theoretical (M06-2X and DFT) investigation, and frequency estimation analyses on (E)-3-(4-bromo-5-methylthiophen-2-yl)acrylonitrile
JournalSpectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy
AuthorsSert, YusufAuthor
Balakit, Asim A.Author
Öztürk, NuriAuthor
Ucun, FatihAuthor
El-Hiti, Gamal A.Author
Year2014 (October)Volume131
PublisherElsevier BV
DOIdoi:10.1016/j.saa.2014.04.105Search in ResearchGate
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Mindat Ref. ID16395618Long-form Identifiermindat:1:5:16395618:7
GUID0
Full ReferenceSert, Yusuf, Balakit, Asim A., Öztürk, Nuri, Ucun, Fatih, El-Hiti, Gamal A. (2014) Experimental (FT-IR, NMR and UV) and theoretical (M06-2X and DFT) investigation, and frequency estimation analyses on (E)-3-(4-bromo-5-methylthiophen-2-yl)acrylonitrile. Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 131. 502-511 doi:10.1016/j.saa.2014.04.105
Plain TextSert, Yusuf, Balakit, Asim A., Öztürk, Nuri, Ucun, Fatih, El-Hiti, Gamal A. (2014) Experimental (FT-IR, NMR and UV) and theoretical (M06-2X and DFT) investigation, and frequency estimation analyses on (E)-3-(4-bromo-5-methylthiophen-2-yl)acrylonitrile. Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 131. 502-511 doi:10.1016/j.saa.2014.04.105
In(2014) Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy Vol. 131. Elsevier BV

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Sert, Yusuf, Singer, L.M., Findlater, M., Doğan, Hatice, Çırak, Ç. (2014) Vibrational frequency analysis, FT-IR, DFT and M06-2X studies on tert-Butyl N-(thiophen-2yl)carbamate. Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 128. 46-53 doi:10.1016/j.saa.2014.02.114
Sert, Yusuf, Sreenivasa, S., Doğan, Hatice, Mohan, N.R., Suchetan, P.A., Ucun, Fatih (2014) Vibrational frequency analysis, FT-IR and Laser-Raman spectra, DFT studies on ethyl (2E)-2-cyano-3-(4-methoxyphenyl)-acrylate. Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 130. 96-104 doi:10.1016/j.saa.2014.03.061
El-Hiti, Gamal A., Smith, Keith, Balakit, Asim A., Masmali, Ali, Kariuki, Benson M. (2013) (E)-3-(4-Bromo-5-methylthiophen-2-yl)acrylonitrile. Acta Crystallographica Section E Structure Reports Online, 69 (9). doi:10.1107/s1600536813019752
Udayakumar, V., Periandy, S., Ramalingam, S. (2011) Experimental (FT-IR and FT-Raman) and theoretical (HF and DFT) investigation, IR intensity, Raman activity and frequency estimation analyses on 1-bromo-4-chlorobenzene. Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 79 (5) 920-927 doi:10.1016/j.saa.2011.03.049
Sert, Yusuf, Al-Turkistani, Abdulghafoor A., Al-Deeb, Omar A., El-Emam, Ali A., Ucun, Fatih, Çırak, Çağrı (2014) Experimental FT-IR, Laser-Raman and DFT spectroscopic analysis of a potential chemotherapeutic agent 6-(2-methylpropyl)-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carbonitrile. Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 120. 97-105 doi:10.1016/j.saa.2013.09.138
Sert, Yusuf, El-Hiti, Gamal A., Gökce, Halil, Ucun, Fatih, Abdel-Wahab, Bakr F., Kariuki, Benson M. (2020) DFT, molecular docking and experimental FT-IR, laser-Raman, NMR and UV investigations on a potential anticancer agent containing triazole ring system. Journal of Molecular Structure, 1211. 128077 doi:10.1016/j.molstruc.2020.128077
Çırak, Çağrı, Sert, Yusuf, Ucun, Fatih (2012) Experimental and computational study on molecular structure and vibrational analysis of a modified biomolecule: 5-Bromo-2′-deoxyuridine. Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 92. 406-414 doi:10.1016/j.saa.2012.02.053
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Sert, Yusuf, Mahendra, M., Chandra, , Shivashankar, K., Puttaraju, K.B., Doğan, H., Çırak, Çagrı, Ucun, Fatih (2014) Vibrational spectroscopy investigation using M06-2X and B3LYP methods analysis on the structure of 2-Trifluoromethyl-10H-benzo[4,5]-imidazo[1,2-a]pyrimidin-4-one. Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 128. 109-118 doi:10.1016/j.saa.2014.02.125
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Gayathri, R., Arivazhagan, M. (2012) Experimental (FT-IR and FT-Raman) and theoretical (HF and DFT) investigation, NMR, NBO, electronic properties and frequency estimation analyses on 2,4,5-trichlorobenzene sulfonyl chloride. Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 97. 311-325 doi:10.1016/j.saa.2012.05.069
 
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