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Forums
Physics
Quantum Physics
How to predict the frequency of NMR spectrum
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[QUOTE="DrClaude, post: 6164240, member: 461323"] This would have to be ##^{31}##P-NMR. One could estimate the chemical shift and intensities by comparing to the NMR of similar molecules. Splittings can be found by considering spin-spin coupling. But generally speaking, a relatively accurate prediction of a NMR spectrum can only be obtained by quantum chemistry calculations. [/QUOTE]
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Physics
Quantum Physics
How to predict the frequency of NMR spectrum
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