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An upper limit on the magnitude of the two-bond 2J HH coupling constant between mutually cis classical hydrides is 6 Hz (trans couplings can be as large as 15 Hz).20-24. Correcting for the H/D gyromagnetic ratio of 6.51 gives a maximum 2JHD coupling constant between cis classical hydrides of about 1 Hz. Interestingly, it is thought that the sign of this coupling constant is negative.24
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34047255007
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We exclude from consideration polyhydrides in which a single ground-state structure is dynamic via a high-energy intermediate and instead restrict our discussion to structures that have non-negligible populations at equilibrium
-
We exclude from consideration polyhydrides in which a single ground-state structure is dynamic via a high-energy intermediate and instead restrict our discussion to structures that have non-negligible populations at equilibrium.
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36
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For a description of the crystallographic programs and procedures used, see
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