| Epicatechin | Catechin | ||||||
Gas phase | Aqueous phase | Gas phase | Aqueous phase | |||||
Atom |
|
|
|
|
|
|
|
|
H13 | 0.129 | 0.015 | 0.133 | −0.118 | 0.130 | 0.015 | 0.133 | 0.011 |
H14 | 0.027 | −0.013 | 0.019 | −0.027 | 0.029 | −0.016 | 0.027 | −0.015 |
H15 | 0.137 | 0.030 | 0.143 | −0.124 | 0.143 | 0.028 | 0.157 | 0.026 |
O16 | −0.267 | 0.058 | −0.273 | 0.267 | −0.270 | 0.042 | −0.274 | 0.038 |
C17 | −0.033 | 0.042 | −0.065 | 0.040 | −0.011 | 0.037 | 0.061 | 0.062 |
C18 | −0.148 | 0.000 | −0.188 | 0.144 | −0.099 | −0.003 | 0.042 | −0.001 |
C19 | −0.122 | 0.052 | −0.101 | 0.121 | −0.116 | 0.055 | −0.133 | 0.075 |
C20 | 0.146 | 0.063 | 0.138 | −0.134 | 0.155 | 0.066 | 0.136 | 0.082 |
H21 | 0.140 | 0.023 | 0.149 | −0.128 | 0.136 | 0.021 | 0.139 | 0.019 |
C22 | −0.159 | −0.007 | −0.183 | 0.152 | −0.025 | −0.005 | 0.080 | −0.003 |
H23 | 0.131 | 0.005 | 0.140 | −0.129 | 0.135 | 0.008 | 0.139 | 0.015 |
C24 | 0.112 | 0.064 | 0.105 | −0.125 | 0.246 | 0.064 | 0.343 | 0.080 |