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Theoretical and experimental vibrational spectroscopic study of 3-piperidino-propylamine

✍ Scribed by Özgür Alver; Cemal Parlak; Mustafa Şenyel


Book ID
108213064
Publisher
Elsevier Science
Year
2009
Tongue
English
Weight
332 KB
Volume
923
Category
Article
ISSN
0022-2860

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The comparative studies of the infrared and Raman spectra of fluoranthene and 3-nitrofluoranthene (3-NF) were made via both FT-IR and density functional theory calculation with a triple f Gaussian basis set (B3LYP/6-311 + G(d,p)). The scaled theoretical vibrational frequencies show good agreement to