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• W1969658007 abstract "Abstract The gas-phase NMR analysis of 5-methoxy-1,3-dioxanes was carried out. The conformational energies estimated from the observed coupling constant data were compared with the results of ab initio MO calculations using d95 + (2df,p) basis set at the MP2 level. While the energy difference between the axial-out and equatorial-out forms was in a reasonable agreement, the 1,5 interaction energy between the methoxy methyl and the ring oxygens was not in accord." @default.
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• W1969658007 date "1997-02-01" @default.
• W1969658007 modified "2023-09-27" @default.
• W1969658007 title "Gas phase NMR and ab initio molecular orbital calculations of 5-methoxy-1,3-dioxanes: a critical survey of the Gauche effect" @default.
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• W1969658007 doi "https://doi.org/10.1016/s0022-2860(96)09621-4" @default.
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