Cubane boat TS for ring expansion and rearrangement
DOI: 10.14469/hpc/1343 Metadata
Created: 2016-08-19 05:22
Last modified: 2018-01-15 11:47
License: Creative Commons: Public Domain Dedication 1.0
Funding: (none given)
Co-author: Donald Craig Co-author: Henry Rzepa
Description
Wagner-Meerwein ring expansion and migration via carbon.
Member of collection / collaboration
| DOI | Description |
|---|---|
| 10.14469/hpc/3116 | Cubane ring expansion |
Members
| DOI | Description |
|---|---|
| 10.14469/hpc/1348 | Cubane_2 (opt ts freq) |
| 10.14469/hpc/1349 | Cubane_iso2 (opt ts freq) |
| 10.14469/hpc/1359 | Cubane_iso2 (opt ts freq) |
| 10.14469/hpc/1360 | Cubane_2 (opt ts freq) |
| 10.14469/hpc/1372 | IRC_Cubane_SO2py_1iso (IRC) |
| 10.14469/hpc/1374 | IRC_Cubane_OMe_1 (IRC) |
| 10.14469/hpc/1375 | IRC_Cubane_OMe_1iso (IRC) |
| 10.14469/hpc/1380 | Cubane_OMe_1 (opt ts freq) |
| 10.14469/hpc/1381 | Cubane_OMe_1iso (opt ts freq) |
| 10.14469/hpc/1383 | IRC_Cubane_iso1 (IRC) |
| 10.14469/hpc/1384 | Cubane_SO2py_iso2 (opt ts freq) |
| 10.14469/hpc/1389 | Cubane_iso3 (opt ts freq) |
| 10.14469/hpc/1390 | IRC_Cubane_SO2py_1 (IRC) |
| 10.14469/hpc/1392 | Cubane_reactant_1 (opt freq) |
| 10.14469/hpc/1393 | Cubane_Product_1 (opt freq) |
| 10.14469/hpc/1395 | Cubane_Product_1iso (opt freq) |
| 10.14469/hpc/1396 | Cubane_Reactant_1iso (opt freq) |
| 10.14469/hpc/1401 | Cubane_OMe_Reactant_1iso (opt freq) |
| 10.14469/hpc/1402 | Cubane_SO2py_Reactant_1 (opt freq) |
| 10.14469/hpc/1403 | Cubane_SO2py_Reactant_1iso (opt freq) |
| 10.14469/hpc/1404 | Cubane_SO2py_Product_1iso (opt freq) |
| 10.14469/hpc/1405 | Cubane_OMe_Reactant_1 (opt freq) |
| 10.14469/hpc/1409 | Cubane_SO2py_Product_1 (opt freq) |
| 10.14469/hpc/1410 | Cubane_OMe_Product_1iso (opt freq) |
| 10.14469/hpc/1411 | Cubane_OMe_Product_1 (opt freq) |
| 10.14469/hpc/1419 | Cubane_SO2pyboat_2 (opt ts freq) |
| 10.14469/hpc/1422 | Cubane_SO2py_2 (opt ts freq) |
| 10.14469/hpc/1427 | IRC_Cubane_1 (IRC) |
| 10.14469/hpc/1429 | Cubane_iso2 (opt ts freq) |
| 10.14469/hpc/1462 | Cubane_OMe_Ph_1iso (opt ts freq) |
| 10.14469/hpc/1463 | Cubane_OMe_Ph_1 (opt ts freq) |
| 10.14469/hpc/1464 | Cubane_OMe_Ph_1 (opt ts freq) |
| 10.14469/hpc/1480 | IRC_Cubane_Ph_OMe_iso1 (IRC) |
| 10.14469/hpc/1481 | IRC_Cubane_Ph_OMe_1 (IRC) |
| 10.14469/hpc/1485 | Cubane_OMe_Ph_1 (opt ts freq) |
| 10.14469/hpc/1521 | Cubane_OMe_Ph_Reactant_iso1 (opt freq) |
| 10.14469/hpc/1522 | Cubane_OMe_Ph_Reactant_1 (opt freq) |
| 10.14469/hpc/1523 | Cubane_OMe_Ph_Product_iso1 (opt freq) |
| 10.14469/hpc/2254 | Cubane_OMe_Ph_Product_1 (opt freq) |
| 10.14469/hpc/2266 | Cubane_SO2py_iso2 (opt ts freq) |
| 10.14469/hpc/2267 | Cubane_SO2py_iso2 (opt ts freq) |
| 10.14469/hpc/2549 | NMR_Cubane_Reactant_1 (NMR) |
| 10.14469/hpc/2550 | NMR_Cubane_Reactant_iso1 (NMR) |
| 10.14469/hpc/2856 | Cubane 2 (freq temp) |
| 10.14469/hpc/2857 | Cubane iso3 (freq temp) |
| 10.14469/hpc/2858 | Cubane reactant iso1 (freq temp) |
| 10.14469/hpc/2859 | Cubane reactant 1 (freq temp) |
| 10.14469/hpc/3017 | Cubane dCr CN substrate 1 (opt freq) |
| 10.14469/hpc/3018 | Cubane dCr CN substrate 1 (NMR) |
| 10.14469/hpc/2749 | IRC Cubane 1 (larger scan to show shorter was satisfactory) |
| 10.14469/hpc/1045 | TMS_NMRreference1 (NMR) |