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Journal Abstract Search

577 related items for PubMed ID: 17879244

  • 1. A theoretical characterization of the photoisomerization channels of 1,2-cyclononadienes on both singlet and triplet potential-energy surfaces.
    Su MD.
    Chemistry; 2007; 13(35):9957-72. PubMed ID: 17879244
    [Abstract] [Full Text] [Related]

  • 2. Quantum mechanical study of the photoisomerizations of bicyclo[4,1,0]hept-2-ene (2-norcarene).
    Su MD.
    J Phys Chem A; 2009 Jan 15; 113(2):381-7. PubMed ID: 19132827
    [Abstract] [Full Text] [Related]

  • 3. CASPT2//CASSCF study on the photolysis mechanism of 2,3-diazabicyclo[2.1.1]hex-2-ene: alpha C-N versus beta C-C cleavage.
    Chen H, Li S.
    J Org Chem; 2006 Nov 24; 71(24):9013-22. PubMed ID: 17109524
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  • 4. Triplet pathways in diarylethene photochromism: photophysical and computational study of dyads containing ruthenium(II) polypyridine and 1,2-bis(2-methylbenzothiophene-3-yl)maleimide units.
    Indelli MT, Carli S, Ghirotti M, Chiorboli C, Ravaglia M, Garavelli M, Scandola F.
    J Am Chem Soc; 2008 Jun 11; 130(23):7286-99. PubMed ID: 18479107
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  • 5. Theoretical and experimental studies on the mechanism of norbornadiene Pauson-Khand cycloadducts photorearrangement. Is there a pathway on the excited singlet potential energy surface?
    Olivella S, Solé A, Lledó A, Ji Y, Verdaguer X, Suau R, Riera A.
    J Am Chem Soc; 2008 Dec 17; 130(50):16898-907. PubMed ID: 19053466
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  • 8. A theoretical study on the thermal ring opening rearrangement of 1H-bicyclo[3.1.0]hexa-3,5-dien-2-one: a case of two state reactivity.
    González-Navarrete P, Coto PB, Polo V, Andrés J.
    Phys Chem Chem Phys; 2009 Sep 07; 11(33):7189-96. PubMed ID: 19672528
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  • 11. Intersystem crossings of the triplet and singlet States in cobalt and copper mononitrosyls.
    Uzunova EL.
    J Phys Chem A; 2009 Oct 22; 113(42):11266-72. PubMed ID: 19788202
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  • 12. Exploring photoinduced decarboxylation mechanism of o-acetylphenylacetic acid from the combined CASSCF and DFT studies.
    Ding L, Fang WH.
    J Org Chem; 2010 Mar 05; 75(5):1630-6. PubMed ID: 20128620
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  • 13. Experimental and theoretical study of the photodissociation reaction of thiophenol at 243 nm: intramolecular orbital alignment of the phenylthiyl radical.
    Lim IS, Lim JS, Lee YS, Kim SK.
    J Chem Phys; 2007 Jan 21; 126(3):034306. PubMed ID: 17249870
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  • 15. Mechanism of the photochemical process of singlet oxygen production by phenalenone.
    Segado M, Reguero M.
    Phys Chem Chem Phys; 2011 Mar 07; 13(9):4138-48. PubMed ID: 21225064
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  • 16. Toward a mechanistic understanding of the photochromism of dimethyldihydropyrenes.
    Boggio-Pasqua M, Bearpark MJ, Robb MA.
    J Org Chem; 2007 Jun 08; 72(12):4497-503. PubMed ID: 17506581
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  • 17. Femtochemistry of Norrish type-I reactions: III. Highly excited ketones--theoretical.
    Diau EW, Kötting C, Sølling TI, Zewail AH.
    Chemphyschem; 2002 Jan 18; 3(1):57-78. PubMed ID: 12465477
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  • 18. Density functional studies of the ground- and excited-state potential-energy curves of stilbene cis-trans isomerization.
    Han WG, Lovell T, Liu T, Noodleman L.
    Chemphyschem; 2002 Feb 15; 3(2):167-78. PubMed ID: 12503124
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  • 19. Ab initio molecular dynamics of excited-state intramolecular proton transfer around a three-state conical intersection in malonaldehyde.
    Coe JD, Martínez TJ.
    J Phys Chem A; 2006 Jan 19; 110(2):618-30. PubMed ID: 16405334
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