DFT data as per Figure S35 (initiation step)
DOI: 10.14469/hpc/3779 Metadata
Created: 2018-03-06 12:36
Last modified: 2019-08-05 18:15
License: Creative Commons: Public Domain Dedication 1.0
Funding: (none given)
Description
DFT data corresponding to the initiation step (as per Figure S35 and Table S4)
Member of collection / collaboration
| DOI | Description |
|---|---|
| 10.14469/hpc/3716 | Exploiting non-covalent interactions for room temperature heteroselectve rac-lactide polymerisation using aluminium catalysts |
Members
| DOI | Description |
|---|---|
| 10.14469/hpc/3790 | VII [tbp, twisted] as per Figure S35 |
| 10.14469/hpc/3791 | VIII [tbp, twisted] as per Figure S35 |
| 10.14469/hpc/5059 | VI(b)-TS [oct, boat] as per Figure S35 |
| 10.14469/hpc/5058 | III(b)-TS [oct, boat] as per Figure S35 |
| 10.14469/hpc/3795 | IRC reverse from III(t)-TS leading to II(t) |
| 10.14469/hpc/3796 | IRC reverse (continued) leading to II(t) [fromIII(t)-TS] |
| 10.14469/hpc/3797 | IRC reverse from III(c)-TS leading to II(c) |
| 10.14469/hpc/3780 | II(t) [tbp, twisted] |
| 10.14469/hpc/3781 | I(c) [sqp, chair] |
| 10.14469/hpc/3782 | I(t) [tbp, twisted] - Job 10036106 |
| 10.14469/hpc/3783 | II(c) [sqp, chair] |
| 10.14469/hpc/3784 | III(t)-TS [oct, twisted] as per Figure S35 |
| 10.14469/hpc/3785 | III(c)-TS [oct, chair] as per Figure S35 |
| 10.14469/hpc/3786 | IV [oct, twisted] as per Figure S35 |
| 10.14469/hpc/3787 | V [oct, twisted] as per Figure S35 |
| 10.14469/hpc/3788 | VI-TS [oct, twisted] as per Figure S35 |
| 10.14469/hpc/3789 | VI(c)-TS [oct, chair] as per Figure S35 |