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

329 related items for PubMed ID: 22864392

  • 1. Combined experimental and theoretical approaches to the molecular structure of 4-(1-formylnaphthalen-2-yloxy)phthalonitrile.
    Tereci H, Askeroğlu İ, Akdemir N, Uçar İ, Büyükgüngör O.
    Spectrochim Acta A Mol Biomol Spectrosc; 2012 Oct; 96():569-77. PubMed ID: 22864392
    [Abstract] [Full Text] [Related]

  • 2. Synthesis, molecular conformation, vibrational and electronic transition, isometric chemical shift, polarizability and hyperpolarizability analysis of 3-(4-methoxy-phenyl)-2-(4-nitro-phenyl)-acrylonitrile: a combined experimental and theoretical analysis.
    Asiri AM, Karabacak M, Kurt M, Alamry KA.
    Spectrochim Acta A Mol Biomol Spectrosc; 2011 Nov; 82(1):444-55. PubMed ID: 21856218
    [Abstract] [Full Text] [Related]

  • 3. Molecular structure investigation and spectroscopic studies on 2,3-difluorophenylboronic acid: a combined experimental and theoretical analysis.
    Karabacak M, Kose E, Atac A, Ali Cipiloglu M, Kurt M.
    Spectrochim Acta A Mol Biomol Spectrosc; 2012 Nov; 97():892-908. PubMed ID: 22902933
    [Abstract] [Full Text] [Related]

  • 4. Synthesis, structural, spectroscopic studies, NBO analysis, NLO and HOMO-LUMO of 4-methyl-N-(3-nitrophenyl)benzene sulfonamide with experimental and theoretical approaches.
    Sarojini K, Krishnan H, Kanakam CC, Muthu S.
    Spectrochim Acta A Mol Biomol Spectrosc; 2013 May; 108():159-70. PubMed ID: 23466326
    [Abstract] [Full Text] [Related]

  • 5. Spectroscopic (infrared, Raman, UV and NMR) analysis, Gaussian hybrid computational investigation (MEP maps/HOMO and LUMO) on cyclohexanone oxime.
    Ramalingam S, Karabacak M, Periandy S, Puviarasan N, Tanuja D.
    Spectrochim Acta A Mol Biomol Spectrosc; 2012 Oct; 96():207-20. PubMed ID: 22683556
    [Abstract] [Full Text] [Related]

  • 6. Quantum mechanical study of the structure and spectroscopic (FT-IR, FT-Raman, 13C, 1H and UV), first order hyperpolarizabilities, NBO and TD-DFT analysis of the 4-methyl-2-cyanobiphenyl.
    Sebastian S, Sundaraganesan N, Karthikeiyan B, Srinivasan V.
    Spectrochim Acta A Mol Biomol Spectrosc; 2011 Feb; 78(2):590-600. PubMed ID: 21195659
    [Abstract] [Full Text] [Related]

  • 7. Structural and spectroscopic characterization of a thiosemicarbazidatodioxouranium(VI) complex: a combined experimental and DFT study.
    Şahin M, Özdemir N, Bal-Demirci T, Ülküseven B, Dinçer M, Soylu MS.
    Spectrochim Acta A Mol Biomol Spectrosc; 2015 Jan 25; 135():994-1001. PubMed ID: 25168237
    [Abstract] [Full Text] [Related]

  • 8. Quantum chemical study on influence of intermolecular hydrogen bonding on the geometry, the atomic charges and the vibrational dynamics of 2,6-dichlorobenzonitrile.
    Agarwal P, Bee S, Gupta A, Tandon P, Rastogi VK, Mishra S, Rawat P.
    Spectrochim Acta A Mol Biomol Spectrosc; 2014 Jan 25; 121():464-82. PubMed ID: 24287056
    [Abstract] [Full Text] [Related]

  • 9. Spectroscopic, electronic structure and natural bond analysis of 2-aminopyrimidine and 4-aminopyrazolo[3,4-d]pyrimidine: a comparative study.
    Prabavathi N, Nilufer A, Krishnakumar V, Akilandeswari L.
    Spectrochim Acta A Mol Biomol Spectrosc; 2012 Oct 25; 96():226-41. PubMed ID: 22683558
    [Abstract] [Full Text] [Related]

  • 10. An experimental and theoretical study on the novel (Z)-1-((naphthalen-2-ylamino)methylene)naphthalen-2(1H)-one crystal.
    Tamer Ö, Dege N, Demirtaş G, Avcı D, Atalay Y, Macit M, Ağar AA.
    Spectrochim Acta A Mol Biomol Spectrosc; 2014 Jan 03; 117():13-23. PubMed ID: 23978793
    [Abstract] [Full Text] [Related]

  • 11. Molecular structure, vibrational spectroscopic (FT-IR, FT-Raman), UV and NBO analysis of 2-chlorobenzonitrile by density functional method.
    Krishnan AR, Saleem H, Subashchandrabose S, Sundaraganesan N, Sebastain S.
    Spectrochim Acta A Mol Biomol Spectrosc; 2011 Feb 03; 78(2):582-9. PubMed ID: 21190895
    [Abstract] [Full Text] [Related]

  • 12. The spectroscopic properties of anticancer drug Apigenin investigated by using DFT calculations, FT-IR, FT-Raman and NMR analysis.
    Mariappan G, Sundaraganesan N, Manoharan S.
    Spectrochim Acta A Mol Biomol Spectrosc; 2012 Sep 03; 95():86-99. PubMed ID: 22617215
    [Abstract] [Full Text] [Related]

  • 13. Experimental and theoretical quantum chemical investigations of 8-hydroxy-5-nitroquinoline.
    Arjunan V, Balamourougane PS, Kalaivani M, Raj A, Mohan S.
    Spectrochim Acta A Mol Biomol Spectrosc; 2012 Oct 03; 96():506-16. PubMed ID: 22728969
    [Abstract] [Full Text] [Related]

  • 14. α-Bromo-2,6-dichlorotoluene: molecular structure, vibrational spectroscopy, natural bond orbital analysis and NMR studies.
    Karunakaran V, Balachandran V.
    Spectrochim Acta A Mol Biomol Spectrosc; 2012 Sep 03; 95():64-72. PubMed ID: 22613125
    [Abstract] [Full Text] [Related]

  • 15. FT-IR, UV-vis, 1H and 13C NMR spectra and the equilibrium structure of organic dye molecule disperse red 1 acrylate: a combined experimental and theoretical analysis.
    Cinar M, Coruh A, Karabacak M.
    Spectrochim Acta A Mol Biomol Spectrosc; 2011 Dec 03; 83(1):561-9. PubMed ID: 21958518
    [Abstract] [Full Text] [Related]

  • 16. Spectral and structural studies of the anti-cancer drug Flutamide by density functional theoretical method.
    Mariappan G, Sundaraganesan N.
    Spectrochim Acta A Mol Biomol Spectrosc; 2014 Jan 03; 117():604-13. PubMed ID: 24103231
    [Abstract] [Full Text] [Related]

  • 17. DFT computations and spectroscopic analysis of a pesticide: chlorothalonil.
    Dhas DA, Joe IH, Roy SD, Freeda TH.
    Spectrochim Acta A Mol Biomol Spectrosc; 2010 Sep 15; 77(1):36-44. PubMed ID: 20537938
    [Abstract] [Full Text] [Related]

  • 18. Synthesis, X-ray structural, characterization, NBO and HOMO-LUMO analysis using DFT study of 4-methyl-N-(naphthalene-1-yl)benzene sulfonamide.
    Sarojini K, Krishnan H, Kanakam CC, Muthu S.
    Spectrochim Acta A Mol Biomol Spectrosc; 2012 Oct 15; 96():657-67. PubMed ID: 22871549
    [Abstract] [Full Text] [Related]

  • 19. Vibrational spectra, UV and NMR, first order hyperpolarizability and HOMO-LUMO analysis of 2-amino-4-chloro-6-methylpyrimidine.
    Jayavarthanan T, Sundaraganesan N, Karabacak M, Cinar M, Kurt M.
    Spectrochim Acta A Mol Biomol Spectrosc; 2012 Nov 15; 97():811-24. PubMed ID: 22902579
    [Abstract] [Full Text] [Related]

  • 20. The molecular structure and vibrational spectra of N-(2,2-diphenylacetyl)-N'-(naphthalen-1yl)-thiourea by Hartree-Fock and density functional methods.
    Arslan H, Mansuroglu DS, Vanderveer D, Binzet G.
    Spectrochim Acta A Mol Biomol Spectrosc; 2009 Apr 15; 72(3):561-71. PubMed ID: 19097820
    [Abstract] [Full Text] [Related]

    Page: [Next] [New Search]
    of 17.