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Alvarez-Rua, C, Garcia-Granda, S, Goswani, S, et al. Multiple hydrogen bonds and tautomerism in naphthyridine derivatives New J Chem, 28 (6): 700-707 2004 Antol, I, Glasovac, Z, Eckert-Maksic, M Ab initio MO and DFT study of syn-sesquinorbornatrienyl dication and its isoelectronic boron analogue New J Chem, 28 (7): 880-886 2004 Aydeniz, Y, Oguz, F, Yaman, A, et al. Barriers to internal rotation around the C-N bond in 3-(o-aryl)-5-methyl-rhodanines using NMR spectroscopy and computational studies. Electron density topological analysis of the transition states Org Biomol Chem, 2 (17): 2426-2436 2004 Berridge, R, Serebryakov, IM, Skabara, PJ, et al. A new series of pi-extended tetrathiafulvalene derivatives incorporating fused furanodithiino and thienodithiino units: a joint experimental and theoretical study J Mater Chem, 14 (18): 2822-2830 2004 Bhat, KL, Brendley, WH, Bock, CW Thermodynamics and kinetics of MTBE degradation: A density functional theory study Soil Sediment Contam, 13 (3): 267-281 2004 Bravo-Zhivotovskii, D, Peleg-Vasserman, H, Kosa, M, et al. The direct synthesis of a silene-organometallic complex Angew Chem-Int Edit, 43 (6): 745-748 2004 Burck, S, Gudat, D, Nieger, M Diphosphanes with polarized and highly reactive P-P bonds Angew Chem-Int Edit, 43 (36): 4801-4804 2004 Cantat, T, Mezailles, N, Ricard, L, et al. A bis(thiophosphinoyl)methanediide palladium complex: Coordinated dianion or nucleophilic carbene complex? Angew Chem-Int Edit, 43 (46): 6382-6385 2004 Chaplin, AB, Harrison, JA, Nielson, AJ, et al. A case for linear agostic interactions: Identification by DFT calculation in a complex of Ta containing a uniquely caged triphenylmethyl C-H hydrogen Dalton Trans, (17): 2643-2648 2004 Chocholousova, J, Spirko, V, Hobza, P First local minimum of the formic acid dimer exhibits simultaneously red-shifted O-H center dot center dot center dot O and improper blue-shifted C-H center dot center dot center dot O hydrogen bonds Phys Chem Chem Phys, 6 (1): 37-41 2004

Alvarez-Rua, C, Garcia-Granda, S, Goswani, S, et al ... · Ab initio MO and DFT study of syn-sesquinorbornatrienyl dication and its isoelectronic boron analogue New J Chem, 28 (7):

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  • Alvarez-Rua, C, Garcia-Granda, S, Goswani, S, et al.Multiple hydrogen bonds and tautomerism in naphthyridine derivativesNew J Chem, 28 (6): 700-707 2004

    Antol, I, Glasovac, Z, Eckert-Maksic, MAb initio MO and DFT study of syn-sesquinorbornatrienyl dication and its isoelectronicboron analogueNew J Chem, 28 (7): 880-886 2004

    Aydeniz, Y, Oguz, F, Yaman, A, et al.Barriers to internal rotation around the C-N bond in 3-(o-aryl)-5-methyl-rhodaninesusing NMR spectroscopy and computational studies. Electron density topologicalanalysis of the transition statesOrg Biomol Chem, 2 (17): 2426-2436 2004

    Berridge, R, Serebryakov, IM, Skabara, PJ, et al.A new series of pi-extended tetrathiafulvalene derivatives incorporating fusedfuranodithiino and thienodithiino units: a joint experimental and theoretical studyJ Mater Chem, 14 (18): 2822-2830 2004

    Bhat, KL, Brendley, WH, Bock, CWThermodynamics and kinetics of MTBE degradation: A density functional theory studySoil Sediment Contam, 13 (3): 267-281 2004

    Bravo-Zhivotovskii, D, Peleg-Vasserman, H, Kosa, M, et al.The direct synthesis of a silene-organometallic complexAngew Chem-Int Edit, 43 (6): 745-748 2004

    Burck, S, Gudat, D, Nieger, MDiphosphanes with polarized and highly reactive P-P bondsAngew Chem-Int Edit, 43 (36): 4801-4804 2004

    Cantat, T, Mezailles, N, Ricard, L, et al.A bis(thiophosphinoyl)methanediide palladium complex: Coordinated dianion ornucleophilic carbene complex?Angew Chem-Int Edit, 43 (46): 6382-6385 2004

    Chaplin, AB, Harrison, JA, Nielson, AJ, et al.A case for linear agostic interactions: Identification by DFT calculation in a complex ofTa containing a uniquely caged triphenylmethyl C-H hydrogenDalton Trans, (17): 2643-2648 2004

    Chocholousova, J, Spirko, V, Hobza, PFirst local minimum of the formic acid dimer exhibits simultaneously red-shifted O-Hcenter dot center dot center dot O and improper blue-shifted C-H center dot center dotcenter dot O hydrogen bondsPhys Chem Chem Phys, 6 (1): 37-41 2004

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