| Epicatechin | Catechin | ||||||
Gas phase | Aqueous phase | Gas phase | Aqueous phase | |||||
Atom |
|
|
|
|
|
|
|
|
H25 | 0.119 | 0.023 | 0.148 | −0.127 | 0.124 | 0.024 | 0.139 | 0.020 |
O26 | −0.350 | 0.064 | −0.355 | 0.368 | −0.342 | 0.068 | −0.351 | 0.072 |
H27 | 0.263 | 0.016 | 0.273 | −0.267 | 0.277 | 0.017 | 0.284 | 0.014 |
O28 | −0.376 | 0.049 | −0.364 | 0.374 | −0.295 | 0.049 | −0.318 | 0.060 |
H29 | 0.256 | 0.020 | 0.278 | −0.269 | 0.377 | 0.021 | 0.380 | 0.017 |
O30 | −0.379 | 0.018 | −0.393 | 0.401 | −0.381 | 0.019 | −0.397 | 0.011 |
H31 | 0.249 | 0.005 | 0.256 | −0.254 | 0.254 | 0.002 | 0.259 | 0.003 |
O32 | −0.360 | 0.021 | −0.363 | 0.383 | −0.311 | 0.025 | −0.362 | 0.020 |
H33 | 0.257 | 0.020 | 0.268 | −0.258 | 0.315 | 0.020 | 0.268 | 0.010 |
O34 | −0.356 | 0.061 | −0.365 | 0.365 | −0.343 | 0.064 | −0.364 | 0.052 |
H35 | 0.257 | 0.021 | 0.267 | −0.253 | 0.282 | 0.021 | 0.266 | 0.012 |