The H → D isotopic substitution of the hydroxylic hydrogen participating in the O-H···O hydrogen bond in the tert-butylalcohol dimer produces an increase of the B and C rotational constants, according to the shrinkage of the OO distance of about 7 mÅ, underlying and sizing the associated Ubbelohde effect.
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Sizing the Ubbelohde effect: the rotational spectrum of a tert-butylalcohol dimer.
Phys Chem Chem Phys
May 2011
Key Laboratory of the Three Gorges Reservoir Region's Eco-environment of Ministry of Education, Chongqing University, Chongqing, 400045, PR China.
The H → D isotopic substitution of the hydroxylic hydrogen participating in the O-H···O hydrogen bond in the tert-butylalcohol dimer produces an increase of the B and C rotational constants, according to the shrinkage of the OO distance of about 7 mÅ, underlying and sizing the associated Ubbelohde effect.
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