| DFT | density-functional theory |
| LC-MS | liquid chromatography-mass spectrometry |
| DMF | dimethylformamide |
| THF | tetrahydrofuran |
| DMSO | dimethyl sulfoxide |
| MeCN | acetonitrile |
| TDDFT | time-dependent density-functional theory |
| HRMS | high-resolution mass spectrometry |
| ESI | electrospray ionisation |
| iPrOH | 2-propanol |
| Et2O | diethyl ether |
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