Browse Collection: HIE_isotopes
HIE_isotopes
https://iochem-bd.bsc.es/browse/handle/100/451701
2026-04-07T15:20:08Z
2026-04-07T15:20:08Z
/EDA/IrH2PhPyIMesPPh3_rot IrH2PhPyIMesPPh3_rotTS_PhPy-frag_sp_nosolv
Nelson, David
https://iochem-bd.bsc.es/browse/handle/100/451924
2025-06-23T10:20:14Z
2025-06-23T12:13:28Z
Title: /EDA/IrH2PhPyIMesPPh3_rot IrH2PhPyIMesPPh3_rotTS_PhPy-frag_sp_nosolv
Authors: Nelson, David
Abstract: 2-Phenylpyridine from [Ir(H)2(PhPy)(IMes)(PPh3)] rotation TS SP M06-L/Def2-QZVP
2025-06-23T12:13:28Z
/EDA/IrH2PhPyIMesPPh3_rot IrH2PhPyIMesPPh3_rotTS_Ir-frag_sp_nosolv
Nelson, David
https://iochem-bd.bsc.es/browse/handle/100/451923
2025-06-23T10:20:14Z
2025-06-23T12:13:29Z
Title: /EDA/IrH2PhPyIMesPPh3_rot IrH2PhPyIMesPPh3_rotTS_Ir-frag_sp_nosolv
Authors: Nelson, David
Abstract: [Ir(H)2(IMes)(PPh3)] from [Ir(H)2(PhPy)(IMes)(PPh3)] rotation TS SP M06-L/Def2-QZVP
2025-06-23T12:13:29Z
/EDA/IrH2PhPyIMesPPh3_rot IrH2PhPyIMesPPh3_rotTS_sp_nosolv
Nelson, David
https://iochem-bd.bsc.es/browse/handle/100/451922
2025-06-23T10:20:14Z
2025-06-23T12:13:29Z
Title: /EDA/IrH2PhPyIMesPPh3_rot IrH2PhPyIMesPPh3_rotTS_sp_nosolv
Authors: Nelson, David
Abstract: [Ir(H)2(PhPy)(IMes)(PPh3)] rotation TS SP M06-L/Def2-QZVP
2025-06-23T12:13:29Z
/EDA/IrH2PhAcIMesPPh3_rot IrH2PhAcIMesPPh3_rotTS_PhAc-frag_sp_nosolv
Nelson, David
https://iochem-bd.bsc.es/browse/handle/100/451921
2025-06-23T10:20:14Z
2025-06-23T12:13:30Z
Title: /EDA/IrH2PhAcIMesPPh3_rot IrH2PhAcIMesPPh3_rotTS_PhAc-frag_sp_nosolv
Authors: Nelson, David
Abstract: Acetophenone from [Ir(H)2(PhAc)(IMes)(PPh3)] rotation TS SP M06-L/Def2-QZVP
2025-06-23T12:13:30Z