BIOMARKERS

Molecular Biopsy of Human Tumors

- a resource for Precision Medicine *

359 related articles for article (PubMed ID: 17047767)

  • 1. Vibrational spectrum of the spin crossover complex [Fe(phen)(2)(NCS)(2)] studied by IR and Raman spectroscopy, nuclear inelastic scattering and DFT calculations.
    Ronayne KL; Paulsen H; Höfer A; Dennis AC; Wolny JA; Chumakov AI; Schünemann V; Winkler H; Spiering H; Bousseksou A; Gütlich P; Trautwein AX; McGarvey JJ
    Phys Chem Chem Phys; 2006 Oct; 8(40):4685-93. PubMed ID: 17047767
    [TBL] [Abstract][Full Text] [Related]  

  • 2. Vibrational study of the Fe(phen)2(NCS)2 spin-crossover complex by density-functional calculations.
    Baranović G; Babić D
    Spectrochim Acta A Mol Biomol Spectrosc; 2004 Apr; 60(5):1013-25. PubMed ID: 15084319
    [TBL] [Abstract][Full Text] [Related]  

  • 3. Estimate of the vibrational contribution to the entropy change associated with the spin transition in the d4 systems [MnIII(pyrol)3tren] and [CrII(depe)2I2].
    Garcia Y; Paulsen H; Schünemann V; Trautwein AX; Wolny JA
    Phys Chem Chem Phys; 2007 Mar; 9(10):1194-201. PubMed ID: 17325765
    [TBL] [Abstract][Full Text] [Related]  

  • 4. Dynamics of an [Fe4S4(SPh)4]2- cluster explored via IR, Raman, and nuclear resonance vibrational spectroscopy (NRVS)-analysis using 36S substitution, DFT calculations, and empirical force fields.
    Xiao Y; Koutmos M; Case DA; Coucouvanis D; Wang H; Cramer SP
    Dalton Trans; 2006 May; (18):2192-201. PubMed ID: 16673033
    [TBL] [Abstract][Full Text] [Related]  

  • 5. DFT/TD-DFT study of the spin transition complex [Fe(pmea)(NCS)2].
    Qu Y
    Spectrochim Acta A Mol Biomol Spectrosc; 2012 Aug; 94():205-9. PubMed ID: 22516125
    [TBL] [Abstract][Full Text] [Related]  

  • 6. Vibrational properties of the trinuclear spin crossover complex [Fe3(4-(2'-hydroxy-ethyl)-1,2,4-triazole)6(H2O)6](CF3SO3)6: a nuclear inelastic scattering, IR, Raman and DFT study.
    Wolny JA; Rackwitz S; Achterhold K; Garcia Y; Muffler K; Naik AD; Schünemann V
    Phys Chem Chem Phys; 2010 Nov; 12(44):14782-8. PubMed ID: 20931141
    [TBL] [Abstract][Full Text] [Related]  

  • 7. Vibrational properties of the polymeric spin crossover (SCO) Fe(II) complexes [{Fe(4-amino-1,2,4-triazole)3}X2]n: a nuclear inelastic scattering (NIS), Raman and DFT study.
    Rackwitz S; Wolny JA; Muffler K; Achterhold K; Rüffer R; Garcia Y; Diller R; Schünemann V
    Phys Chem Chem Phys; 2012 Nov; 14(42):14650-60. PubMed ID: 23032912
    [TBL] [Abstract][Full Text] [Related]  

  • 8. Detection and determination of the {Fe(NO)(2)} core vibrational features in dinitrosyl-iron complexes from experiment, normal coordinate analysis, and density functional theory: an avenue for probing the nitric oxide oxidation state.
    Dai RJ; Ke SC
    J Phys Chem B; 2007 Mar; 111(9):2335-46. PubMed ID: 17295535
    [TBL] [Abstract][Full Text] [Related]  

  • 9. Electronic structure of six-coordinate iron(III)-porphyrin NO adducts: the elusive iron(III)-NO(radical) state and its influence on the properties of these complexes.
    Praneeth VK; Paulat F; Berto TC; George SD; Näther C; Sulok CD; Lehnert N
    J Am Chem Soc; 2008 Nov; 130(46):15288-303. PubMed ID: 18942830
    [TBL] [Abstract][Full Text] [Related]  

  • 10. Density functional calculations on the structure, vibrational frequencies and normal modes of 7-Azaindole.
    Karthikeyan B
    Spectrochim Acta A Mol Biomol Spectrosc; 2006 Jul; 64(4):1083-7. PubMed ID: 16458064
    [TBL] [Abstract][Full Text] [Related]  

  • 11. Vibrational spectroscopy of N-phenylmaleimide.
    Parker SF
    Spectrochim Acta A Mol Biomol Spectrosc; 2006 Mar; 63(3):544-9. PubMed ID: 16157505
    [TBL] [Abstract][Full Text] [Related]  

  • 12. Synthesis, infrared spectra, thermal analyses and structural studies of half-sandwich Fe(III)/Fe(II) complex containing pyridine-2,6-dicarboxylate and 1,10-phenanthroline.
    Hu X; Guo J; Wang Y; Liu C
    Spectrochim Acta A Mol Biomol Spectrosc; 2009 Sep; 74(1):48-51. PubMed ID: 19540797
    [TBL] [Abstract][Full Text] [Related]  

  • 13. Structure and vibrational frequencies of 1-naphthaldehyde based on density functional theory calculations.
    Krishnakumar V; Prabavathi N; Muthunatesan S
    Spectrochim Acta A Mol Biomol Spectrosc; 2008 Feb; 69(2):528-33. PubMed ID: 17553736
    [TBL] [Abstract][Full Text] [Related]  

  • 14. A vibrational and DFT study of M(diimine)(dithiolate) complexes and their complexation route.
    Makedonas C; Mitsopoulou CA
    Spectrochim Acta A Mol Biomol Spectrosc; 2006 Jul; 64(4):918-30. PubMed ID: 16455293
    [TBL] [Abstract][Full Text] [Related]  

  • 15. 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; 74(1):200-4. PubMed ID: 19560961
    [TBL] [Abstract][Full Text] [Related]  

  • 16. Spectroscopic and theoretical studies on cobalt (II) complex of maleonitriledithiolate and 5-nitro-1,10-phenanthroline.
    Liu Y; Pan Q; Peng Z; Li D; Zhou Y
    Spectrochim Acta A Mol Biomol Spectrosc; 2007 Sep; 68(1):78-84. PubMed ID: 17185028
    [TBL] [Abstract][Full Text] [Related]  

  • 17. [IR and Raman spectra of ternary solid complexes of rare earth with alpha-naphthoic acid and 1,10-phenanthroline].
    Yang H; Wang ZM; Yang HF; Yu XB
    Guang Pu Xue Yu Guang Pu Fen Xi; 2003 Jun; 23(3):522-4. PubMed ID: 12953531
    [TBL] [Abstract][Full Text] [Related]  

  • 18. Spin crossover transition of Fe(phen)2(NCS)2: periodic dispersion-corrected density-functional study.
    Bučko T; Hafner J; Lebègue S; Ángyán JG
    Phys Chem Chem Phys; 2012 Apr; 14(16):5389-96. PubMed ID: 22415338
    [TBL] [Abstract][Full Text] [Related]  

  • 19. Experimental and theoretical studies on vibrational spectra of 4-(2-furanylmethyleneamino)antipyrine, 4-benzylideneaminoantipyrine and 4-cinnamilideneaminoantipyrine.
    Sun YX; Hao QL; Yu ZX; Jiang WJ; Lu LD; Wang X
    Spectrochim Acta A Mol Biomol Spectrosc; 2009 Sep; 73(5):892-901. PubMed ID: 19451018
    [TBL] [Abstract][Full Text] [Related]  

  • 20. Vibrational spectroscopy investigation and density functional theory calculations on N-benzoylhydrazine ligand and the corresponding uranyl complex.
    Bahgat K
    Spectrochim Acta A Mol Biomol Spectrosc; 2004 Jun; 60(7):1557-62. PubMed ID: 15147698
    [TBL] [Abstract][Full Text] [Related]  

    [Next]    [New Search]
    of 18.