Skip to main page content
U.S. flag

An official website of the United States government

Dot gov

The .gov means it’s official.
Federal government websites often end in .gov or .mil. Before sharing sensitive information, make sure you’re on a federal government site.

Https

The site is secure.
The https:// ensures that you are connecting to the official website and that any information you provide is encrypted and transmitted securely.

Access keys NCBI Homepage MyNCBI Homepage Main Content Main Navigation

Search Page

Filters

My NCBI Filters

Text availability

Article attribute

Article type

Publication date

Search Results

79 results

Filters applied: . Clear all
Results are displayed in a computed author sort order. The Results By Year timeline is not available.
Page 1
Spectroscopic (FT-IR, FT-Raman) investigations and quantum chemical calculations of 1,7,8,9-tetrachloro-10,10-dimethoxy-4-{3-[4-(3-methoxyphenyl)piperazin-1-yl]propyl}-4-azatricyclo[5.2.1.0(2,6)]dec-8-ene-3,5-dione.
Renjith R, Sheena Mary Y, Yohannan Panicker C, Varghese HT, Pakosińska-Parys M, Van Alsenoy C, Al-Saadi AA. Renjith R, et al. Spectrochim Acta A Mol Biomol Spectrosc. 2014 Aug 14;129:438-50. doi: 10.1016/j.saa.2014.03.077. Epub 2014 Apr 1. Spectrochim Acta A Mol Biomol Spectrosc. 2014. PMID: 24747931
Molecular conformational analysis, vibrational spectra, NBO analysis and first hyperpolarizability of (2E)-3-phenylprop-2-enoic anhydride based on density functional theory calculations.
Sheena Mary Y, Raju K, Panicker CY, Al-Saadi AA, Thiemann T, Van Alsenoy C. Sheena Mary Y, et al. Spectrochim Acta A Mol Biomol Spectrosc. 2014 Jul 15;128:638-46. doi: 10.1016/j.saa.2014.02.194. Epub 2014 Mar 19. Spectrochim Acta A Mol Biomol Spectrosc. 2014. PMID: 24704480
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.
Mary YS, Panicker CY, Yamuna TS, Siddegowda MS, Yathirajan HS, Al-Saadi AA, Van Alsenoy C. Mary YS, et al. Spectrochim Acta A Mol Biomol Spectrosc. 2014 Nov 11;132:491-501. doi: 10.1016/j.saa.2014.05.016. Epub 2014 May 16. Spectrochim Acta A Mol Biomol Spectrosc. 2014. PMID: 24892527
Theoretical investigations on the molecular structure, vibrational spectra, HOMO-LUMO analyses and NBO study of 1-[(Cyclopropylmethoxy)methyl]-5-ethyl-6-(4-methylbenzyl)-1,2,3,4-tetrahydropyrimidine-2,4-dione.
Al-Abdullah ES, Mary YS, Panicker CY, El-Brollosy NR, El-Emam AA, Van Alsenoy C, Al-Saadi AA. Al-Abdullah ES, et al. Spectrochim Acta A Mol Biomol Spectrosc. 2014 Dec 10;133:639-50. doi: 10.1016/j.saa.2014.06.042. Epub 2014 Jun 14. Spectrochim Acta A Mol Biomol Spectrosc. 2014. PMID: 24992922
79 results