These tools will no longer be maintained as of December 31, 2024. Archived website can be found here. PubMed4Hh GitHub repository can be found here. Contact NLM Customer Service if you have questions.


Pubmed for Handhelds

PUBMED FOR HANDHELDS

Journal Abstract Search

680 related items for PubMed ID: 21531171

  • 1. Synthesis, FTIR, FT-Raman, UV-visible, ab initio and DFT studies on benzohydrazide.
    Arjunan V, Rani T, Mythili CV, Mohan S.
    Spectrochim Acta A Mol Biomol Spectrosc; 2011 Aug; 79(3):486-96. PubMed ID: 21531171
    [Abstract] [Full Text] [Related]

  • 2. Spectroscopic studies, potential energy surface and molecular orbital calculations of pramipexole.
    Muthu S, Uma Maheswari J, Srinivasan S, Isac paulraj E.
    Spectrochim Acta A Mol Biomol Spectrosc; 2013 Nov; 115():64-73. PubMed ID: 23831980
    [Abstract] [Full Text] [Related]

  • 3. Experimental (FT-IR and FT-Raman), electronic structure and DFT studies on 1-methoxynaphthalene.
    Govindarajan M, Ganasan K, Periandy S, Karabacak M.
    Spectrochim Acta A Mol Biomol Spectrosc; 2011 Aug; 79(3):646-53. PubMed ID: 21530378
    [Abstract] [Full Text] [Related]

  • 4. Spectroscopic studies (FTIR, FT-Raman and UV-Visible), normal coordinate analysis, NBO analysis, first order hyper polarizability, HOMO and LUMO analysis of (1R)-N-(Prop-2-yn-1-yl)-2,3-dihydro-1H-inden-1-amine molecule by ab initio HF and density functional methods.
    Muthu S, Ramachandran G.
    Spectrochim Acta A Mol Biomol Spectrosc; 2014 Aug; 121():394-403. PubMed ID: 24280302
    [Abstract] [Full Text] [Related]

  • 5. Revised vibrational band assignments for the experimental IR and Raman spectra of 2,3,4-trifluorobenzonitrile based on ab initio, DFT and normal coordinate calculations.
    Hiremath CS, Kalkoti GB, Aralakkanavar MK.
    Spectrochim Acta A Mol Biomol Spectrosc; 2009 Sep 15; 74(1):200-4. PubMed ID: 19560961
    [Abstract] [Full Text] [Related]

  • 6. Molecular docking, spectroscopic studies and quantum calculations on nootropic drug.
    Uma Maheswari J, Muthu S, Sundius T.
    Spectrochim Acta A Mol Biomol Spectrosc; 2014 Apr 05; 123():503-10. PubMed ID: 24487180
    [Abstract] [Full Text] [Related]

  • 7. Quantum chemical and spectroscopic investigations of 5-aminoquinoline.
    Arjunan V, Mohan S, Balamourougane PS, Ravindran P.
    Spectrochim Acta A Mol Biomol Spectrosc; 2009 Dec 05; 74(5):1215-23. PubMed ID: 19854675
    [Abstract] [Full Text] [Related]

  • 8. FT-IR, FT-Raman, ab initio and DFT structural, vibrational frequency and HOMO-LUMO analysis of 1-naphthaleneacetic acid methyl ester.
    Nagabalasubramanian PB, Karabacak M, Periandy S.
    Spectrochim Acta A Mol Biomol Spectrosc; 2011 Nov 05; 82(1):169-80. PubMed ID: 21820351
    [Abstract] [Full Text] [Related]

  • 9. FT-IR and FT-Raman, UV spectroscopic investigation of 1-bromo-3-fluorobenzene using DFT (B3LYP, B3PW91 and MPW91PW91) calculations.
    Mahadevan D, Periandy S, Karabacak M, Ramalingam S.
    Spectrochim Acta A Mol Biomol Spectrosc; 2011 Nov 05; 82(1):481-92. PubMed ID: 21840753
    [Abstract] [Full Text] [Related]

  • 10. Investigation of the structural and harmonic vibrational properties of 2-nitro-, 4-nitro- and 5-nitro-m-xylene by ab initio and density functional theory.
    Arjunan V, Balamourougane PS, Saravanan I, Mohan S.
    Spectrochim Acta A Mol Biomol Spectrosc; 2009 Oct 15; 74(3):798-807. PubMed ID: 19716338
    [Abstract] [Full Text] [Related]

  • 11. Vibrational spectroscopic (FT-IR and FT-Raman), first-order hyperpolarizablity, HOMO, LUMO, NBO, Mulliken charges and structure determination of 2-bromo-4-chlorotoluene.
    Arunagiri C, Arivazhagan M, Subashini A.
    Spectrochim Acta A Mol Biomol Spectrosc; 2011 Sep 15; 79(5):1747-56. PubMed ID: 21680229
    [Abstract] [Full Text] [Related]

  • 12. Molecular structure, spectroscopic characterization (FT-IR, FT-Raman, UV and NMR), HOMO and LUMO analysis of 3-ethynylthiophene with DFT quantum chemical calculations.
    Karabacak M, Bilgili S, Mavis T, Eskici M, Atac A.
    Spectrochim Acta A Mol Biomol Spectrosc; 2013 Nov 15; 115():709-18. PubMed ID: 23886506
    [Abstract] [Full Text] [Related]

  • 13. FTIR, FT-Raman spectra and ab initio, DFT vibrational analysis of 2,4-dinitrophenylhydrazine.
    Sundaraganesan N, Ayyappan S, Umamaheswari H, Joshua BD.
    Spectrochim Acta A Mol Biomol Spectrosc; 2007 Jan 15; 66(1):17-27. PubMed ID: 16815087
    [Abstract] [Full Text] [Related]

  • 14. Vibrational spectroscopy (FT-IR and FT-Raman) investigation, and hybrid computational (HF and DFT) analysis on the structure of 2,3-naphthalenediol.
    Shoba D, Periandy S, Karabacak M, Ramalingam S.
    Spectrochim Acta A Mol Biomol Spectrosc; 2011 Dec 15; 83(1):540-52. PubMed ID: 21943712
    [Abstract] [Full Text] [Related]

  • 15. Molecular structure, vibrational spectroscopic (FT-IR, FT-Raman), UV-vis spectra, first order hyperpolarizability, NBO analysis, HOMO and LUMO analysis, thermodynamic properties of benzophenone 2,4-dicarboxylic acid by ab initio HF and density functional method.
    Chaitanya K.
    Spectrochim Acta A Mol Biomol Spectrosc; 2012 Feb 15; 86():159-73. PubMed ID: 22137747
    [Abstract] [Full Text] [Related]

  • 16. Experimental (FT-IR, FT-Raman) and theoretical (HF and DFT) investigation and HOMO and LUMO analysis on the structure of p-fluoronitrobenzene.
    Udayakumar V, Periandy S, Karabacak M, Ramalingam S.
    Spectrochim Acta A Mol Biomol Spectrosc; 2011 Dec 15; 83(1):575-86. PubMed ID: 21955946
    [Abstract] [Full Text] [Related]

  • 17. Spectroscopic and quantum chemical studies on 4-acryloyl morpholine.
    Arjunan V, Rani T, Santhanalakshmi K, Mohan S.
    Spectrochim Acta A Mol Biomol Spectrosc; 2011 Sep 15; 79(5):1386-94. PubMed ID: 21621452
    [Abstract] [Full Text] [Related]

  • 18.
    ; . PubMed ID:
    [No Abstract] [Full Text] [Related]

  • 19.
    ; . PubMed ID:
    [No Abstract] [Full Text] [Related]

  • 20.
    ; . PubMed ID:
    [No Abstract] [Full Text] [Related]

    Page: [Next] [New Search]
    of 34.