View source for Rep:LH3115TSS ex2jmol

==JMOLS==
{|+ Table: Jmol files of the Diels-alder reaction (Exercise 1).
|-
! 1,3 Dioxol
! Cyclohexadiene
! Transition state ENDO
! Transition state EXO
! EXO Product
! ENDO Product
|-
| <jmol>
  <jmolApplet>
  <color>white</color>
  <size>200</size>
  <script>frame 18; mo 18; mo nodots nomesh fill translucent; mo titleformat ; set antialiasdisplay on</script>
  <uploadedFileContents>EX2_13DIOXOL2_OPTMIN_B3LYP_LH3115.LOG</uploadedFileContents>
  </jmolApplet>
  </jmol>
| <jmol>
  <jmolApplet>
  <color>white</color>
  <size>200</size>
  <script>frame 18; mo 21; mo nodots nomesh fill translucent; mo titleformat ; set antialiasdisplay on</script>
  <uploadedFileContents>EX2_CYCLOHEXADIENE_OPTMIN_B3LYP_LH3115.LOG</uploadedFileContents>
  </jmolApplet>
  </jmol>
| <jmol>
  <jmolApplet>
  <color>white</color>
  <size>200</size>
  <script>frame 28; mo 40; mo nodots nomesh fill translucent; mo titleformat ; set antialiasdisplay on</script>
  <uploadedFileContents>EX2_ENDO_TSOPTAFTERFEEZEREOPTIMIZE_B3LYP_LH3115.LOG</uploadedFileContents>
  </jmolApplet>
  </jmol>
| <jmol>
  <jmolApplet>
  <color>white</color>
  <size>200</size>
  <script>frame 16; mo 40; mo nodots nomesh fill translucent; mo titleformat ; set antialiasdisplay on</script>
  <uploadedFileContents>EX2_EXO_TSOPTAFTERFEEZE_B3LYP_LH3115.LOG</uploadedFileContents>
  </jmolApplet>
  </jmol>
| <jmol>
  <jmolApplet>
  <color>white</color>
  <size>200</size>
  <script>frame 18; mo 40; mo nodots nomesh fill translucent; mo titleformat ; set antialiasdisplay on</script>
  <uploadedFileContents>EX2_ENDO_IRCOPTMINOFPRODUCT_B3LYP_LH3115.LOG</uploadedFileContents>
  </jmolApplet>
  </jmol>
| <jmol>
  <jmolApplet>
  <color>white</color>
  <size>200</size>
  <script>frame 14; mo 40; mo nodots nomesh fill translucent; mo titleformat ; set antialiasdisplay on</script>
  <uploadedFileContents>EX2_EXO_PRODUCTOFTEST5_IRC_B3LYP_LH3115.LOG</uploadedFileContents>
  </jmolApplet>
  </jmol>
|-
| <jmol>
  <jmolApplet>
  <color>white</color>
  <size>200</size>
  <script>frame 18; mo 19; mo nodots nomesh fill translucent; mo titleformat ; set antialiasdisplay on</script>
  <uploadedFileContents>EX2_13DIOXOL2_OPTMIN_B3LYP_LH3115.LOG</uploadedFileContents>
  </jmolApplet>
  </jmol>
| <jmol>
  <jmolApplet>
  <color>white</color>
  <size>200</size>
  <script>frame 18; mo 22; mo nodots nomesh fill translucent; mo titleformat ; set antialiasdisplay on</script>
  <uploadedFileContents>EX2_CYCLOHEXADIENE_OPTMIN_B3LYP_LH3115.LOG</uploadedFileContents>
  </jmolApplet>
  </jmol>
| <jmol>
  <jmolApplet>
  <color>white</color>
  <size>200</size>
  <script>frame 28; mo 41; mo nodots nomesh fill translucent; mo titleformat ; set antialiasdisplay on</script>
  <uploadedFileContents>EX2_ENDO_TSOPTAFTERFEEZEREOPTIMIZE_B3LYP_LH3115.LOG</uploadedFileContents>
  </jmolApplet>
  </jmol>
| <jmol>
  <jmolApplet>
  <color>white</color>
  <size>200</size>
  <script>frame 16; mo 41; mo nodots nomesh fill translucent; mo titleformat ; set antialiasdisplay on</script>
  <uploadedFileContents>EX2_EXO_TSOPTAFTERFEEZE_B3LYP_LH3115.LOG</uploadedFileContents>
  </jmolApplet>
  </jmol>
| <jmol>
  <jmolApplet>
  <color>white</color>
  <size>200</size>
  <script>frame 18; mo 41; mo nodots nomesh fill translucent; mo titleformat ; set antialiasdisplay on</script>
  <uploadedFileContents>EX2_ENDO_IRCOPTMINOFPRODUCT_B3LYP_LH3115.LOG</uploadedFileContents>
  </jmolApplet>
  </jmol>
| <jmol>
  <jmolApplet>
  <color>white</color>
  <size>200</size>
  <script>frame 14; mo 41; mo nodots nomesh fill translucent; mo titleformat ; set antialiasdisplay on</script>
  <uploadedFileContents>EX2_EXO_PRODUCTOFTEST5_IRC_B3LYP_LH3115.LOG</uploadedFileContents>
  </jmolApplet>
  </jmol>
|-
| <jmol>
  <jmolApplet>
  <color>white</color>
  <size>200</size>
  <script>frame 18; mo 21; mo nodots nomesh fill translucent; mo titleformat ; set antialiasdisplay on</script>
  <uploadedFileContents>EX2_13DIOXOL2_OPTMIN_B3LYP_LH3115.LOG</uploadedFileContents>
  </jmolApplet>
  </jmol>
| <jmol>
  <jmolApplet>
  <color>white</color>
  <size>200</size>
  <script>frame 18; mo 23; mo nodots nomesh fill translucent; mo titleformat ; set antialiasdisplay on</script>
  <uploadedFileContents>EX2_CYCLOHEXADIENE_OPTMIN_B3LYP_LH3115.LOG</uploadedFileContents>
  </jmolApplet>
  </jmol>
| <jmol>
  <jmolApplet>
  <color>white</color>
  <size>200</size>
  <script>frame 28; mo 42; mo nodots nomesh fill translucent; mo titleformat ; set antialiasdisplay on</script>
  <uploadedFileContents>EX2_ENDO_TSOPTAFTERFEEZEREOPTIMIZE_B3LYP_LH3115.LOG</uploadedFileContents>
  </jmolApplet>
  </jmol>
| <jmol>
  <jmolApplet>
  <color>white</color>
  <size>200</size>
  <script>frame 16; mo 42; mo nodots nomesh fill translucent; mo titleformat ; set antialiasdisplay on</script>
  <uploadedFileContents>EX2_EXO_TSOPTAFTERFEEZE_B3LYP_LH3115.LOG</uploadedFileContents>
  </jmolApplet>
  </jmol>
| <jmol>
  <jmolApplet>
  <color>white</color>
  <size>200</size>
  <script>frame 18; mo 42; mo nodots nomesh fill translucent; mo titleformat ; set antialiasdisplay on</script>
  <uploadedFileContents>EX2_ENDO_IRCOPTMINOFPRODUCT_B3LYP_LH3115.LOG</uploadedFileContents>
  </jmolApplet>
  </jmol>
| <jmol>
  <jmolApplet>
  <color>white</color>
  <size>200</size>
  <script>frame 14; mo 42; mo nodots nomesh fill translucent; mo titleformat ; set antialiasdisplay on</script>
  <uploadedFileContents>EX2_EXO_PRODUCTOFTEST5_IRC_B3LYP_LH3115.LOG</uploadedFileContents>
  </jmolApplet>
  </jmol>
|-
| <jmol>
  <jmolApplet>
  <color>white</color>
  <size>200</size>
  <script>frame 18; mo 22; mo nodots nomesh fill translucent; mo titleformat ; set antialiasdisplay on</script>
  <uploadedFileContents>EX2_13DIOXOL2_OPTMIN_B3LYP_LH3115.LOG</uploadedFileContents>
  </jmolApplet>
  </jmol>
| <jmol>
  <jmolApplet>
  <color>white</color>
  <size>200</size>
  <script>frame 18; mo 24; mo nodots nomesh fill translucent; mo titleformat ; set antialiasdisplay on</script>
  <uploadedFileContents>EX2_CYCLOHEXADIENE_OPTMIN_B3LYP_LH3115.LOG</uploadedFileContents>
  </jmolApplet>
  </jmol>
| <jmol>
  <jmolApplet>
  <color>white</color>
  <size>200</size>
  <script>frame 28; mo 43; mo nodots nomesh fill translucent; mo titleformat ; set antialiasdisplay on</script>
  <uploadedFileContents>EX2_ENDO_TSOPTAFTERFEEZEREOPTIMIZE_B3LYP_LH3115.LOG</uploadedFileContents>
  </jmolApplet>
  </jmol>
| <jmol>
  <jmolApplet>
  <color>white</color>
  <size>200</size>
  <script>frame 16; mo 43; mo nodots nomesh fill translucent; mo titleformat ; set antialiasdisplay on</script>
  <uploadedFileContents>EX2_EXO_TSOPTAFTERFEEZE_B3LYP_LH3115.LOG</uploadedFileContents>
  </jmolApplet>
  </jmol>
| <jmol>
  <jmolApplet>
  <color>white</color>
  <size>200</size>
  <script>frame 18; mo 43; mo nodots nomesh fill translucent; mo titleformat ; set antialiasdisplay on</script>
  <uploadedFileContents>EX2_ENDO_IRCOPTMINOFPRODUCT_B3LYP_LH3115.LOG</uploadedFileContents>
  </jmolApplet>
  </jmol>
| <jmol>
  <jmolApplet>
  <color>white</color>
  <size>200</size>
  <script>frame 14; mo 43; mo nodots nomesh fill translucent; mo titleformat ; set antialiasdisplay on</script>
  <uploadedFileContents>EX2_EXO_PRODUCTOFTEST5_IRC_B3LYP_LH3115.LOG</uploadedFileContents>
  </jmolApplet>
  </jmol>
|}