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Journal Abstract Search

439 related items for PubMed ID: 17425291

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  • 5. Ab initio study of complexes with two cations as N-H donors to F-: structures and spin-spin coupling constants across N-H-F hydrogen bonds.
    Del Bene JE, Elguero J.
    J Phys Chem A; 2005 Dec 01; 109(47):10753-8. PubMed ID: 16863124
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  • 8. Ab initio study of hydrogen bonding and proton transfer in 3:1 FH:NH3 and FH:collidine complexes: structures and one- and two-bond coupling constants across hydrogen bonds.
    Del Bene JE, Elguero J.
    J Phys Chem A; 2006 Jan 26; 110(3):1128-33. PubMed ID: 16420017
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  • 14. Ab initio study of ternary complexes A...NCH...C with A,C = HCN, HF, HCl, ClF, and LiH: energetics and spin-spin coupling constants across intermolecular bonds.
    Del Bene JE, Alkorta I, Elguero J.
    J Phys Chem A; 2010 Aug 19; 114(32):8463-73. PubMed ID: 20701355
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  • 18. Ab initio study of ternary complexes X:(HCNH)(+):Z with X, Z = NCH, CNH, FH, ClH, and FCl: diminutive cooperative effects on structures, binding energies, and spin-spin coupling constants across hydrogen bonds.
    Del Bene JE, Alkorta I, Elguero J.
    J Phys Chem A; 2011 Nov 17; 115(45):12677-87. PubMed ID: 21639084
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  • 19. Do traditional, chlorine-shared, and ion-pair halogen bonds exist? An ab initio investigation of FCl:CNX complexes.
    Del Bene JE, Alkorta I, Elguero J.
    J Phys Chem A; 2010 Dec 16; 114(49):12958-62. PubMed ID: 21080716
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