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. Author manuscript; available in PMC: 2014 Jul 17.
Published in final edited form as: J Am Chem Soc. 2013 Jul 8;135(28):10388–10395. doi: 10.1021/ja4024463

Table 1.

Arrhenius Parameters Derived from Fits of the 1/T1 Data.

Compound Group causing the relaxation Ea (kcal/mol) τ0−1 (s−1) C (s−2)
3 OMe + BCO 2.5a
OMeb 3.2 1.0 × 1012* 1.0 × 108*
3-d6 BCO 1.15c 2.5 × 1011* 6.8 × 108*
8 OMe 1.9 1.9 × 1011 1.4 × 108
8-d3 Me 1.35c 3.3 × 1011* 1.7 × 108*
a

Apparent activation energy resulting from contributions of two groups.

b

Obtained from the difference between compounds 3 and 3-d6 (SI, Figure S8)

c

Obtained from linear regression of the data.

*

Resulting from 1/T1 data extrapolation using the Kubo-Tomita expression.