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. 2018 Oct 5;3(10):12688–12702. doi: 10.1021/acsomega.8b01523

Figure 3.

Figure 3

Correlation between hydrogen bond length r (N–H···O) and stabilization energy (ΔEBSSE) at MP2/aug-cc-pVTZ level. Series 1 implies the complexes of azole with water. Series 2 implies the complexes of azole with HP.