Items where Author is "Mary, Y. Sheena"

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Article

Jalaja, K. and Mary, Y. Sheena and Panicker, C. Yohannan and Armaković, Stevan and Armaković, Sanja J. and Sagar, B. K. and Girisha, M. and Yathirajan, H. S. and Van Alsenoy, C. (2017) Spectroscopic characterization of 4-[2-(5-Ethylpyridin-2-yl)ethoxy]benzaldehyde oxime and investigation of its reactive properties by DFT calculations and molecular dynamics simulations. Journal of Molecular Structure, 1128. pp. 245-256. ISSN 0022-2860

Chidan Kumar, C. S. and Panicker, C. Yohannan and Fun, Hoong-Kun and Mary, Y. Sheena and Harikumar, B. and Chandraju, S. and Quah, Ching Kheng and Ooi, Chin Wei (2014) FT-IR, molecular structure, first order hyperpolarizability, HOMO and LUMO analysis, MEP and NBO analysis of 2-(4-chlorophenyl)-2-oxoethyl 3-nitrobenzoate. Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 126. pp. 208-219. ISSN 1386-1425

Mary, Y. Sheena and Panicker, C. Y. and Yamuna, T. S. and Siddegowda, M.S. and Yathirajan, H. S. and Al-Saadi, Abdulaziz A. and Alsenoy, Christian Van (2014) Theoretical investigations on the molecular structure, vibrational spectral, HOMO-LUMO and {NBO} analysis of 9-3-(Dimethylamino)propyl-2-trifluoro-methyl-9H-thioxanthen-9-ol. Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy , 132. 491- 501.

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