Table 2. Synthetic Details for BM Experiments of Zn-BDC Compoundsa.
| milling parameters |
||||||
|---|---|---|---|---|---|---|
| code name | formula | mZnO (mg) | mH2BDC (mg) | VH2O (μL) | frequency (Hz) | duration (min) |
| ZTA1 | Zn(BDC)(H2O)2 | 129.9 | 265.1 | 115 | 30 | 30 |
| 1.59 mmol | 1.59 mmol | 6.38 mmol | ||||
| 1 equiv | 1 equiv | 4 equiv | ||||
| ZTA2a | Zn2(OH)2(BDC) | 178.4 | 182.1 | 40 | 50 | 20 |
| 2.19 mmol | 1.09 mmol | 2.22 mmol | ||||
| 2 equiv | 1 equiv | 2 equiv | ||||
| ZTA2b | Zn2(OH)2(BDC) | 197.8 | 201.9 | 350 | 50 | 90 |
| 2.43 mmol | 1.21 mmol | 19.43 mmol | ||||
| 2 equiv | 1 equiv | 16 equiv | ||||
| ZTA3 | Zn3(OH)4(BDC) | 262.1 | 178.4 | 310 | 50 | 90 |
| 3.22 mmol | 1.07 mmol | 17.21 mmol | ||||
| 3 equiv | 1 equiv | 16 equiv | ||||
| 17O-Labeled Compounds | ||||||
| ZTA1-*BDC | Zn(BDC)(H2O)2 | 34.0 | 71.0* | 17 | 50 | 5 |
| 0.42 mmol | 0.42 mmol | 0.94 mmol | ||||
| 1 equiv | 1 equiv | 2 equiv | ||||
| ZTA2a-*BDC | Zn2(OH)2(BDC) | 60.9 | 63.6* | 15 | 50 | 12 |
| 0.75 mmol | 0.37 mmol | 0.83 mmol | ||||
| 2 equiv | 1 equiv | 2 equiv | ||||
| ZTA2a-*OH | 178.4 | 182.1 | 40* | 50 | 20 | |
| 2.19 mmol | 1.10 mmol | 2.20 mmol | ||||
| 2 equiv | 1 equiv | 2 equiv | ||||
| ZTA2b-*OH | Zn2(OH)2(BDC) | 171.2 | 174.7 | 40* | 50 | 90 |
| 2.10 mmol | 1.05 mmol | 2.20 mmol | ||||
| 2 equiv | 1 equiv | 2 equiv | ||||
| ZTA3-*BDC | Zn3(OH)4(BDC) | 121.1 | 84.3* | 50 | 50 | 90 |
| 1.49 mmol | 0.49 mmol | 2.77 mmol | ||||
| 3 equiv | 1 equiv | 5 equiv | ||||
| ZTA3-*OH | 119.6 | 81.4 | 50* | |||
| 1.47 mmol | 0.48 mmol | 2.77 mmol | ||||
| 3 equiv | 1 equiv | 5 equiv | ||||
| Deuterated Compounds | ||||||
| ZTA1-d4BDC | Zn(d4BDC)(H2O)2 | 125.0 | 262.0d | 315 | 30 | 15 |
| 1.54 mmol | 1.54 mmol | 17.48 mmol | ||||
| 1 equiv | 1 equiv | 11.2 equiv | ||||
| ZTA2a-d4BDC | Zn2(OH)2(d4BDC) | 197.4 | 207.5d | 350 | 50 | 90 |
| 2.42 mmol | 1.22 mmol | 19.43 mmol | ||||
| 2 equiv | 1 equiv | 16 equiv | ||||
| ZTA2b-OD | Zn2(OD)2(BDC) | 188.1 | 192.8 | 335d | 50 | 90 |
| 2.31 mmol | 1.16 mmol | 18.47 mmol | ||||
| 2 equiv | 1 equiv | 16 equiv | ||||
| ZTA3-d4BDC | Zn3(OH)4(d4BDC) | 242.0 | 168.7d | 90 | 50 | 90 |
| 2.97 mmol | 0.99 mmol | 5.00 mmol | ||||
| 3 equiv | 1 equiv | 5 equiv | ||||
| ZTA3-OD | Zn3(OD)4(BDC) | 250.7 | 171.1 | 350d | ||
| 3.08 mmol | 1.03 mmol | 19.06 mmol | ||||
| 3 equiv | 1 equiv | 19 equiv | ||||
“*” is used for 17O-labeled materials and “d” is used for deuterated materials (prepared from D2O or d4-BDC precursors).