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Journal Abstract Search
193 related items for PubMed ID: 25813170
1. Study on molecular structure, spectroscopic behavior, NBO, and NLO analysis of 3-methylbezothiazole-2-thione. Chand S, Al-Omary FA, El-Emam AA, Shukla VK, Prasad O, Sinha L. Spectrochim Acta A Mol Biomol Spectrosc; 2015 Jul 05; 146():129-41. PubMed ID: 25813170 [Abstract] [Full Text] [Related]
2. Experimental (FT-IR, FT-Raman, UV and NMR) and quantum chemical studies on molecular structure, spectroscopic analysis, NLO, NBO and reactivity descriptors of 3,5-Difluoroaniline. Pathak SK, Srivastava R, Sachan AK, Prasad O, Sinha L, Asiri AM, Karabacak M. Spectrochim Acta A Mol Biomol Spectrosc; 2015 Jan 25; 135():283-95. PubMed ID: 25078461 [Abstract] [Full Text] [Related]
5. An experimental and theoretical investigation of Acenaphthene-5-boronic acid: conformational study, NBO and NLO analysis, molecular structure and FT-IR, FT-Raman, NMR and UV spectra. Karabacak M, Sinha L, Prasad O, Asiri AM, Cinar M. Spectrochim Acta A Mol Biomol Spectrosc; 2013 Nov 25; 115():753-66. PubMed ID: 23892116 [Abstract] [Full Text] [Related]
7. FTIR, FT-RAMAN, NMR, spectra, normal co-ordinate analysis, NBO, NLO and DFT calculation of N,N-diethyl-4-methylpiperazine-1-carboxamide molecule. Muthu S, Elamurugu Porchelvi E. Spectrochim Acta A Mol Biomol Spectrosc; 2013 Nov 25; 115():275-86. PubMed ID: 23845985 [Abstract] [Full Text] [Related]
8. Vibrational and UV spectra, first order hyperpolarizability, NBO and HOMO-LUMO analysis of 4-chloro-N-(2-methyl-2,3-dihydroindol-1-yl)-3-sulfamoyl-benzamide. Muthu S, Rajamani T, Karabacak M, Asiri AM. Spectrochim Acta A Mol Biomol Spectrosc; 2014 Mar 25; 122():1-14. PubMed ID: 24291448 [Abstract] [Full Text] [Related]
9. FT-IR, FT-Raman and UV spectroscopic investigation, electronic properties, electric moments, and NBO analysis of anethole using quantum chemical calculations. Sinha L, Prasad O, Chand S, Sachan AK, Pathak SK, Shukla VK, Karabacak M, Asiri AM. Spectrochim Acta A Mol Biomol Spectrosc; 2014 Dec 10; 133():165-77. PubMed ID: 24934975 [Abstract] [Full Text] [Related]
10. Experimental and theoretical (FT-IR, FT-Raman, UV-vis, NMR) spectroscopic analysis and first order hyperpolarizability studies of non-linear optical material: (2E)-3-[4-(methylsulfanyl) phenyl]-1-(4-nitrophenyl) prop-2-en-1-one using density functional theory. Kumar A, Deval V, Tandon P, Gupta A, Deepak D'silva E. Spectrochim Acta A Mol Biomol Spectrosc; 2014 Sep 15; 130():41-53. PubMed ID: 24762572 [Abstract] [Full Text] [Related]