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Research Publications:  Temperature dependence of chemical shifts in isolated molecules

COLLABORATORS

Norman C. Craig
    Oberlin College
Angel C. de Dios
    Georgetown University
Martin Hoch
A. Keith Jameson
James Moyer
H. Jörg Osten
    Leibniz Univ Hannover
    Germany
Dieter Rehder
    Univ Hamburg

TALKS ON THIS TOPIC

The T dependence of chemical shifts

22. Variation of chemical shielding with internal coordinates. Applications to diatomic molecules, C. J. Jameson, J. Chem. Phys. 66, 4977-4982 (1977).
23. The isotope shift in NMR, C. J. Jameson, J. Chem. Phys. 66, 4983-4988 (1977).
26. The dependence of 19F nuclear magnetic shielding on internal coordinates in CF4, SiF4, and BF3, C. J. Jameson, J. Chem. Phys. 67, 2814-2820 (1977).
30. Variation of chemical shielding with intermolecular interactions and rovibrational motion IV. 11B and 13C nuclei in BF3 and CH4, A. K. Jameson, J. Moyer, and C. J. Jameson, J. Chem. Phys. 68, 2873-2877 (1978).
32. Effect of centrifugal distortion and anharmonic vibration on the chemical shielding of 31P in PH3 and PD3, C. J. Jameson and A. K. Jameson, J. Chem. Phys. 69, 615-621 (1978).
34. Effect of centrifugal distortion and anharmonic vibration on the 19F chemical shielding in CH3F, C. J. Jameson and A. K. Jameson, J. Chem. Phys. 69, 1655-1660 (1978).
40. Effects of vibrational anharmonicity on 19F nuclear resonance in SF6, C. J. Jameson, Mol. Phys. 40, 999-1003 (1980).
42. Effects of intermolecular interactions and intramolecular dynamics on nuclear resonance, C. J. Jameson, Bull. Magn. Reson. 3, 3-28 (1980).
57. The effect of anharmonic vibration and centrifugal distortion on nuclear shielding in linear triatomic molecules: NNO and CO2, C. J. Jameson and H. J. Osten, J. Chem. Phys. 81, 2556-2561 (1984).
59. The dependence of the 13C and the 1H nuclear magnetic shielding on bond extension in methane, H. J. Osten and C. J. Jameson, J. Chem. Phys. 81, 4288-4292 (1984).
60. The additivity of NMR isotope shifts, C. J. Jameson and H. J. Osten, J. Chem. Phys. 81, 4293-4299 (1984).
61. The NMR isotope shift in polyatomic molecules. Estimation of the dynamic factors, C. J. Jameson and H. J. Osten, J. Chem. Phys. 81, 4300-4305 (1984); 83, 915 (1985).
62. The mean bond displacements in O=CF2 and their effect on 19F nuclear magnetic shielding, C. J. Jameson and H. J. Osten, J. Chem. Phys. 81, 4915-4921, (1984).
64. Correlation between the 19F absolute nuclear magnetic shielding and its temperature dependence in the fluoromethanes, C. J. Jameson, Mol. Phys. 54, 73-79 (1985).
66. Systematic trends in the variation of 19F nuclear magnetic shielding with bond extension in halomethanes, C. J. Jameson and H. J. Osten, Mol. Phys. 55, 383-395 (1985).
68. Rovibrational effects on nuclear shielding of apex nuclei in bent molecules, H. J. Osten and C. J. Jameson, J. Chem. Phys. 82, 4595-4606 (1985).
69. Application of the reduced isotope shift to general estimation of one-bond isotope shifts in NMR, C. J. Jameson and H. J. Osten, J. Am. Chem. Soc. 107, 4158-4161 (1985).
71. The mean bond displacements and the derivatives of 19F shielding in CF2=CFX and CF2=CH2, C. J. Jameson and H. J. Osten, J. Chem. Phys. 83, 5425-5433 (1985).
72. Deuterium-induced 19F isotope shifts in fluoroethenes, H. J. Osten, C. J. Jameson, and N. C. Craig, J. Chem. Phys. 83 5434-5441 (1985).
73. Rovibrational averaging of molecular magnetic properties of CH3F, CH2F2, and CHF3, C. J. Jameson and H. J. Osten, Mol. Phys. 56, 1083-1095 (1985).
74. Isotope effects on spin-spin coupling, C. J. Jameson and H. J. Osten, J. Am. Chem. Soc. 108, 2497-2503 (1986).
76. Theoretical aspects of the isotope effect on nuclear shielding, C. J. Jameson and H. J. Osten, a review chapter in Annual Reports on NMR Spectroscopy, G. A. Webb, ed. Academic Press, London, 1986, Vol. 17, 1-78.
82. Rovibrational averaging of nuclear shielding in MX6-type molecules, C. J. Jameson, and A. K. Jameson, J. Chem. Phys. 85, 5484-5492 (1986).
84. Vibrational analysis and mean bond displacements in M(XY)6 complexes, C. J. Jameson, J. Am. Chem. Soc. 109, 2586-2588 (1987).
85. Isotope and temperature dependence of transition metal shielding in complexes of the type M(XY)6, C. J. Jameson, D. Rehder, M. Hoch, J. Am. Chem. Soc. 109, 2589-2594 (1987).
95. The effects of rovibrational averaging on the 93Nb chemical shift in [Nb(CO)6]- ion, based on NMR and vibrational spectra, C. J. Jameson, D. Rehder and M. Hoch, Inorg. Chem., 27, 3490-3495 (1988).
102. Rovibrational averaging of molecular electronic properties, C. J. Jameson, a chapter in Theoretical Models of Chemical Bonding, Z. B. Maksic, ed., Part 3. Molecular Spectroscopy, Electronic Structure, and Intramolecular Interactions, Springer-Verlag, Berlin, 1991, pp. 457-519.
103. The dynamic and electronic factors in isotope effects on NMR parameters, C. J. Jameson, a chapter in Isotopes in the Physical and Biomedical Sciences, E. Buncel and J. R. Jones, Vol. 2. Isotopic Applications in NMR Studies Elsevier, Amsterdam, 1991, Chap. 1, pp. 1-54.
105. Deuterium isotope effects and bonding in carbonylvanadium complexes, D. Rehder, M. Hoch, and C. J. Jameson, Magn. Reson. Chem., 28, 138-144 (1990).
111. Nuclear magnetic shielding of nitrogen in ammonia, C. J. Jameson, A. C. de Dios, and A. K. Jameson, J. Chem. Phys., 95, 1069-1079 (1991).
114. The 31P shielding in phosphine, C. J. Jameson, A. C. de Dios, and A. K. Jameson, J. Chem. Phys., 95, 9042-9053 (1991).
115. Gas phase NMR spectroscopy, C. J. Jameson, Chem. Rev., 91, 1375-1395 (1991).
120. The nuclear magnetic shielding as a function of internuclear separation, C. J. Jameson and A. C. de Dios, J. Chem. Phys., 98, 2208-2217 (1993).
121. The nuclear shielding surface: The shielding as a function of molecular geometry and intermolecular separation, C. J. Jameson and A. C. de Dios, in Nuclear Magnetic Shielding and Molecular Structure J. A. Tossell, ed., Kluwer Academic Publishers, Dordrecht, 1993, pp. 95-116.
139. Isotope effects on chemical shifts and coupling constants, C. J. Jameson, Encyclopedia of Nuclear Magnetic Resonance, Vol. 4, pp. 2638-2655 (1996) D. M. Grant and R. K. Harris, eds., John Wiley, London.
144. Understanding NMR chemical shifts, C. J. Jameson, Ann. Rev. Phys. Chem. 47, 135-169 (1996).
217. Fundamental intramolecular and intermolecular information from NMR in the Gas Phase, Cynthia J. Jameson, a chapter in Gas Phase Nuclear Magnetic Resonance, ed. Michal Jaszunski and Karol Jackowski, eds., Royal Society of Chemistry, London, 2015.

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