Uploads by Shp13
This special page shows all uploaded files.
| Date | Name | Thumbnail | Size | Description | Versions |
|---|---|---|---|---|---|
| 19:18, 22 October 2015 | Exo TS labelled.png (file) |  |
70 KB | 1 | |
| 19:18, 22 October 2015 | Endo TS labelled.png (file) |  |
54 KB | 1 | |
| 16:35, 22 October 2015 | Exo product diagram.png (file) |  |
34 KB | 1 | |
| 16:35, 22 October 2015 | Endo product diagram.png (file) |  |
33 KB | 1 | |
| 16:29, 22 October 2015 | TS GUESS EXOO IRC 100.mol (file) |  |
2 KB | 1 | |
| 16:29, 22 October 2015 | TS GUESS ENDO IRC 100.mol (file) | |
2 KB | 1 | |
| 15:40, 22 October 2015 | TS guess endo imafreq.gif (file) |  |
657 KB | 1 | |
| 15:37, 22 October 2015 | TS guess exo imafreq.gif (file) |  |
667 KB | 1 | |
| 15:33, 22 October 2015 | TS GUESS EXO DERIVATIVE BERNY AM1.mol (file) | |
2 KB | 1 | |
| 15:33, 22 October 2015 | TS GUESS ENDO DERIVATIVE BERNY AM1.mol (file) | |
2 KB | 1 | |
| 13:26, 22 October 2015 | TS lowestpostivive frequency.gif (file) |  |
623 KB | 1 | |
| 12:50, 22 October 2015 | TS guess 631G IRC 150 energy.png (file) |  |
12 KB | 1 | |
| 12:50, 22 October 2015 | TS guess 631G IRC 150 grad.png (file) |  |
14 KB | 1 | |
| 10:38, 22 October 2015 | Labeled TS.png (file) |  |
37 KB | 1 | |
| 10:26, 22 October 2015 | LUMO TS.png (file) |  |
65 KB | 1 | |
| 10:26, 22 October 2015 | HOMO TS.png (file) |  |
57 KB | 1 | |
| 10:13, 22 October 2015 | TS IRC 421G 100 energy.png (file) |  |
11 KB | 1 | |
| 10:13, 22 October 2015 | TS IRC 421G 100 grad.png (file) |  |
14 KB | 1 | |
| 10:03, 22 October 2015 | REACT CISBUTADIENE 631G.mol (file) | |
1,008 bytes | 1 | |
| 09:54, 22 October 2015 | TS IR 631G.png (file) |  |
11 KB | 1 | |
| 09:54, 22 October 2015 | TS 631G TS berny imafreq.gif (file) |  |
578 KB | 1 | |
| 09:51, 22 October 2015 | TS GUESS 631G BERNY.mol (file) | |
2 KB | 1 | |
| 09:37, 22 October 2015 | TS guess Bernymethod try3.mol (file) | |
2 KB | 1 | |
| 09:36, 22 October 2015 | TS AM1 imaginaryfreq anim.gif (file) |  |
595 KB | 1 | |
| 09:35, 22 October 2015 | TS IR AM1.png (file) |  |
11 KB | 1 | |
| 09:17, 22 October 2015 | LUMO cisbutadiene reactant.png (file) |  |
50 KB | 1 | |
| 09:17, 22 October 2015 | HOMO cisbutadiene reactant.png (file) |  |
27 KB | 1 | |
| 09:06, 22 October 2015 | React cisbutadiene AMI.mol (file) | |
1,008 bytes | 1 | |
| 19:05, 21 October 2015 | IRC results.png (file) |  |
27 KB | 1 | |
| 18:25, 21 October 2015 | TS QST2 imaginary freq.gif (file) |  |
768 KB | 1 | |
| 18:21, 21 October 2015 | Output qst2.mol (file) | |
2 KB | 1 | |
| 18:19, 21 October 2015 | Input react &prod QST2.png (file) |  |
56 KB | 1 | |
| 17:16, 21 October 2015 | TS IR guess derivative.png (file) |  |
9 KB | 1 | |
| 17:16, 21 October 2015 | TS guess chair derivative imaginaryfreq anim.gif (file) |  |
569 KB | 1 | |
| 16:34, 21 October 2015 | TS guess chair imaginaryfreq anim.gif (file) |  |
725 KB | 2 | |
| 16:21, 21 October 2015 | IR spec chair guess TS.png (file) |  |
12 KB | 1 | |
| 16:03, 21 October 2015 | TS guess chair 321G sp.mol (file) | |
2 KB | 1 | |
| 10:28, 21 October 2015 | TS allyl 321G SP.mol (file) | |
820 bytes | 1 | |
| 10:27, 21 October 2015 | REACT ANTI1631G sp.mol (file) | |
2 KB | 1 | |
| 10:27, 21 October 2015 | REACT ANTI1 sp.mol (file) | |
2 KB | 1 | |
| 10:27, 21 October 2015 | REACT GAUCHE1 sp.mol (file) | |
2 KB | 1 | |
| 10:18, 21 October 2015 | REACT ANTI sp.mol (file) | |
2 KB | 2 | |
| 18:44, 20 October 2015 | Compariing conformers newman sp.png (file) |  |
3 KB | 1 | |
| 18:12, 20 October 2015 | IR spectrum 631G freq anti1.png (file) |  |
16 KB | 1 | |
| 17:43, 20 October 2015 | Labelled anti2.png (file) |  |
52 KB | 1 | |
| 17:22, 20 October 2015 | Actual lowest energy conformer sp.png (file) |  |
993 bytes | 1 | |
| 17:00, 20 October 2015 | Hypothesis lowest energy conformer sp.png (file) |  |
999 bytes | 1 | |
| 16:45, 19 October 2015 | Endo exo diels aldrer sp.png (file) |  |
7 KB | 1 | |
| 15:56, 19 October 2015 | Simple diels alder sp.png (file) |  |
1 KB | 1 | |
| 15:48, 19 October 2015 | Cope rearrangement sp.png (file) |  |
1 KB | 1 |
