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- W2015540300 abstract "13C chemical shifts have been measured relative to 13CO in the zero-pressure limit for over twenty molecules for which theoretical calculations of 13C nuclear shielding have recently been reported. Rovibrational averaging effects on the spin-rotation constant in 13C16O have been used to find σe(13C in 13C16O) = 3.0 ± 1.2 ppm and σ0(13C in 13C16O) = 1.0 ± 1.2 ppm. With the latter, the σ0 values for the 13C nuclei in this work have been determined absolutely and compared with calculated values. Agreement is generally good in most cases except where low-lying n → π★ transitions contribute significantly to the paramagnetic shielding." @default.
- W2015540300 created "2016-06-24" @default.
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- W2015540300 date "1987-03-01" @default.
- W2015540300 modified "2023-10-16" @default.
- W2015540300 title "Gas-phase 13C chemical shifts in the zero-pressure limit: refinements to the absolute shielding scale for 13C" @default.
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- W2015540300 doi "https://doi.org/10.1016/0009-2614(87)87173-7" @default.
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