Table 1. Hydrogen Bond Acceptor Strengths (pKBHX Scale) and Frequencies Observed in the CSD for Selected Hydrogen Bonds Types.
typical acceptor strength (pKBHX) | frequency of hydrogen bond to OH [%] | |
---|---|---|
Acyclic Oxygen Acceptors | ||
amide | 2.2−2.6 | 48 |
ketone | 1.1−1.2 | 39 |
sulfone | 1.1 | 37 |
sulfonamide | 1.0 | 30 |
ether | 1.0−1.2 | 16 |
Planar Heterocycles | ||
N-alkylated imidazole N | 2.72 | 41 |
pyridine N | 1.86 | 32 |
oxazole N | 1.67 | 30 |
pyrazine N | 0.92 | 25 |
furane O | −0.4 | 0.5 |