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- 19:01, 1 March 2014 Jm4311 talk contribs uploaded File:20140301 B-MeSty Ox predicted 4 detail 2.JPG (Predicted NMR)
- 19:00, 1 March 2014 Jm4311 talk contribs uploaded File:20140301 B-MeSty Ox predicted 4 detail 1.JPG (Predicted NMR)
- 18:59, 1 March 2014 Jm4311 talk contribs uploaded File:20140301 B-MeSty Ox predicted 4.JPG (Predicted NMR)
- 18:47, 1 March 2014 Jm4311 talk contribs uploaded File:20140228 B-MeSty Ox predicted detail 2.JPG (Predicted NMR)
- 18:46, 1 March 2014 Jm4311 talk contribs uploaded File:20140228 B-MeSty Ox predicted detail 1.JPG (Predicted NMR)
- 18:45, 1 March 2014 Jm4311 talk contribs uploaded File:20140228 B-MeSty Ox predicted 1b CORRECTED.JPG (Predicted NMR)
- 18:44, 1 March 2014 Jm4311 talk contribs uploaded File:20140301 B-MeSty Ox predicted NMR numbering.JPG (Predicted NMR numbering)
- 18:43, 1 March 2014 Jm4311 talk contribs uploaded File:20140301 B-MeSty Ox B3LYP 6-31Gdp nmr s-s mixed chloro freq GD3.mol (Methylstyrene oxide)
- 18:27, 1 March 2014 Jm4311 talk contribs uploaded File:20140301 Styrene Ox B3LYP 6-31Gdp nmr s-s mixed chloro freq GD3 88690.mol (Styrene oxide)
- 18:26, 1 March 2014 Jm4311 talk contribs uploaded File:20140228 Styrene Ox predicted detail 2.JPG (Predicted NMR)
- 18:25, 1 March 2014 Jm4311 talk contribs uploaded File:20140228 Styrene Ox predicted detail 1.JPG (Predicted NMR)
- 18:23, 1 March 2014 Jm4311 talk contribs uploaded File:20140228 Styrene Ox predicted 2a.JPG (Predicted NMR)
- 18:22, 1 March 2014 Jm4311 talk contribs uploaded File:20140301 Styrene Ox predicted NMR numbering.JPG (Predicted NMR numbering)
- 17:55, 1 March 2014 Jm4311 talk contribs uploaded File:20140228 H2napth Ox predicted detail 2.JPG (Predicted NMR)
- 17:55, 1 March 2014 Jm4311 talk contribs uploaded File:20140228 H2napth Ox predicted detail 1.JPG (Predicted NMR)
- 17:54, 1 March 2014 Jm4311 talk contribs uploaded File:20140228 H2napth Ox predicted 1a.JPG (Predicted NMR)
- 17:53, 1 March 2014 Jm4311 talk contribs uploaded File:20140301 H2napth Ox predicted NMR numbering.JPG (Predicted NMR numbering)
- 17:52, 1 March 2014 Jm4311 talk contribs uploaded File:20140301 H2napth Ox B3LYP 6-31Gpd nmr s-s mixed chloro f 88689.mol (Dihydronapthalene)
- 17:41, 1 March 2014 Jm4311 talk contribs uploaded File:20140301 Stilbene Ox predicted detail 2 CORRECTED AGAIN.JPG (Predicted NMR)
- 17:36, 1 March 2014 Jm4311 talk contribs uploaded File:20140301 Stilbene Ox B3LYP 6-31Gdp nmr s-s mixed chlor freq 88688.mol (Stilbene oxide)
- 17:33, 1 March 2014 Jm4311 talk contribs uploaded File:20140301 Stilbene Ox predicted NMR numbering.JPG (Predicted NMR)
- 17:26, 1 March 2014 Jm4311 talk contribs uploaded File:20140301 Stilbene Ox predicted detail 2 CORRECTED.JPG (Predicted NMR)
- 17:26, 1 March 2014 Jm4311 talk contribs uploaded File:20140301 Stilbene Ox predicted 3 CORRECTED AGAIN.JPG (Predicted NMR)
- 17:00, 1 March 2014 Jm4311 talk contribs uploaded File:20140228 Stilbene Ox predicted detail 2.JPG (Predicted NMR)
- 16:59, 1 March 2014 Jm4311 talk contribs uploaded File:20140228 Stilbene Ox predicted detail 1.JPG (Predicted NMR)
- 16:57, 1 March 2014 Jm4311 talk contribs uploaded File:20140228 Stilbene Ox predicted 2b CORRECTED.JPG (Predicted NMR)
- 13:33, 1 March 2014 Jm4311 talk contribs uploaded File:20140301 Taxol precursor QST3 B3LYP 6-31Gp 88766 imaginary vibration2.gif (Chair-boat O-up transition state)
- 13:18, 1 March 2014 Jm4311 talk contribs uploaded File:20140228 Taxol precursor O-up 9 from Avogadro MMFF94s 102,35881 ts.mol ('Sideways' guess at the transition state)
- 21:43, 28 February 2014 Jm4311 talk contribs uploaded File:20140228 Taxol precursor O-up 9 from Avogadro MMFF94s 88,16573 unstable boat.mol ('O-up' unstable boat form)
- 21:16, 28 February 2014 Jm4311 talk contribs uploaded File:20140228 Taxol precursor O-down 10 from Avogadro MMFF94s 81,52509 unstable boat.mol (O-down unstable boat form)
- 20:53, 28 February 2014 Jm4311 talk contribs uploaded File:20140228 Taxol precursor O-down 10 from Avogadro MMFF94s 74,75838 unstable chair.mol (Unstable O-down chair form)
- 20:23, 28 February 2014 Jm4311 talk contribs uploaded File:20140228 Taxol precursor O-up 9 from Avogadro MMFF94s 70,53838 stable chair.mol (O-up stable chair form)
- 20:18, 28 February 2014 Jm4311 talk contribs uploaded File:20140228 Taxol precursor O-up 9 from Avogadro MMFF94s 76,28966 boat form.mol (O-up boat form)
- 20:08, 28 February 2014 Jm4311 talk contribs uploaded File:20140228 Taxol precursor O-up 9 from Avogadro MMFF94s 82,74304.mol (Very high energy intermediate conformation)
- 19:50, 28 February 2014 Jm4311 talk contribs uploaded File:20140228 Taxol precursor O-down 10 from Avogadro MMFF94s 60,55146.mol (MMFF94s 10 with energy 60,55146 kcal/mol)
- 19:49, 28 February 2014 Jm4311 talk contribs uploaded File:20140228 Taxol precursor O-down 10 from Avogadro MMFF94s.mol (MMFF94s 10)
- 19:24, 28 February 2014 Jm4311 talk contribs uploaded File:20140228 Taxol precursor O-up 9 from Avogadro MMFF94s.mol (MMFF94s 9)
- 17:01, 27 February 2014 Jm4311 talk contribs uploaded File:20140227 Dimerisation EXO Berny TS noeigen opt freq once HF 3-21G mo36 HOMO.cub.xyz
- 17:00, 27 February 2014 Jm4311 talk contribs uploaded File:20140227 Dimerisation EXO Berny TS noeigen opt freq once HF 3-21G mo36 HOMO.cub.jvxl
- 16:56, 27 February 2014 Jm4311 talk contribs uploaded File:20140227 Dimerisation ENDO Berny TS noeigen opt freq once HF 3-21G mo36 HOMO.cub.xyz
- 16:51, 27 February 2014 Jm4311 talk contribs uploaded File:20140227 Dimerisation ENDO Berny TS noeigen opt freq once HF 3-21G mo36 HOMO.cub.jvxl
- 16:15, 27 February 2014 Jm4311 talk contribs uploaded File:20140227 Dimerisation ENDO Berny TS noeigen opt freq once HF 3-21G.mol (Endo transition state)
- 16:04, 27 February 2014 Jm4311 talk contribs uploaded File:20140227 Dimerisation ENDO Berny TS noeigen opt freq once HF 3-21G imaginary.gif (Endo transition state animation)
- 15:51, 27 February 2014 Jm4311 talk contribs uploaded File:20140227 Dimerisation EXO Berny TS noeigen opt freq once HF 3-21G imaginary.gif (Transition state imaginary frequency animation)
- 15:50, 27 February 2014 Jm4311 talk contribs uploaded File:20140227 Dimerisation EXO Berny TS noeigen opt freq once HF 3-21G.mol (Exo transition state)
- 14:06, 27 February 2014 Jm4311 talk contribs uploaded File:20140227 Coupling for O-down 18 in benzene 88617 C nmr.svg (Predicted 'O-down' carbon NMR spectrum)
- 14:04, 27 February 2014 Jm4311 talk contribs uploaded File:20140227 Coupling for O-down 18 in benzene 88617 H nmr.svg (Predicted 'O-down' proton NMR spectrum)
- 13:15, 27 February 2014 Jm4311 talk contribs uploaded File:20140227 Coupling constants for O-up 17 in chloroform 88616 C nmr.svg (Predicted 'O-up' carbon NMR spectrum)
- 13:13, 27 February 2014 Jm4311 talk contribs uploaded File:20140227 Coupling constants for O-up 17 in chloroform 88616 H nmr.svg (Predicted 'O-up' proton spectrum)
- 21:48, 26 February 2014 Jm4311 talk contribs uploaded File:20140226 Hydrogenated 3B dimer Avogadro MMFF94s HIGHER ENERGY.mol (Higher energy conformer)