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. 2021 Feb 5;26(4):843. doi: 10.3390/molecules26040843

Table 1.

A summary of the important bonds and distances involving PT process of enol form for all complexes in the S0 and S1 states.

Compound Important Bond Distance (Å)
S0 State S1 State
O1–H1 O2⋯H1 Ow⋯H1 Ow–Hw O2⋯Hw O1–H1 O2⋯H1 Ow⋯H1 Ow–Hw O2⋯Hw
3HF 0.983 1.920 1.017 1.706
3HFW 1.000 2.387 1.630 0.984 1.723 1.069 2.439 1.394 1.008 1.572
Form I 0.979 1.978 1.002 1.804
Form II 0.981 2.177 0.996 2.080
Form I-W 1.009 2.390 1.585 0.977 1.808 1.030 2.415 1.503 0.978 1.903
Form II-W 1.004 2.429 1.612 0.983 1.733 1.078 2.452 1.375 1.006 1.581