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Advanced Chemdraw
Created by S. Chantal E. Stieber, California State Polytechnic University Pomona
(sestieber@cpp.edu) and posted on VIPEr (www.ionicviper.org) on February 11, 2019.
Copyright S. Chantal E. Stieber, 2019. This work is licensed under the Creative
Commons Attribution-NonCommercial-ShareAlike 3.0 Unported License. To view a copy
of this license visit http://creativecommons.org/about/license/.
Advanced ChemDraw
Chemdraw 16 user manual
Insert image of Chemdraw user interface from page 4 of the Chemdraw 16.0
user manual.
Advanced ChemDraw
Mantell, M. A.; Kampf, J. W.; Sanford, M. Improved Synthesis of [CpRRhCl2]2 Complexes, Organometallics, 2018, DOI:
10.1021/acs.organomet.8b00400
Drawing Complex 3-D Structures:
• Target complex:
Insert image of dirhodium
complex from upper right in
Scheme 1 in Sanford paper
DOI:
10.1021/acs.organomet.8b0
0400
Advanced ChemDraw
Drawing Complex 3-D Structures:
• Start with the ligands that you will distort:
Insert image of dirhodium
complex from upper right in
Scheme 1 in Sanford paper
DOI:
10.1021/acs.organomet.8b0
0400
Advanced ChemDraw
Drawing Complex 3-D Structures:
• Select the whole ligand:
• Distort it in 3-D
Insert image of dirhodium
complex from upper right in
Scheme 1 in Sanford paper
DOI:
10.1021/acs.organomet.8b0
0400
Advanced ChemDraw
Drawing Complex 3-D Structures:
• Add shading:
• Adjust the circle as needed:
Insert image of dirhodium
complex from upper right in
Scheme 1 in Sanford paper
DOI:
10.1021/acs.organomet.8b0
0400
Advanced ChemDraw
Drawing Complex 3-D Structures:
• Copy/paste first ring
• Flip vertically to make second ring:
• Remove wedges, rotate, and add shading
Insert image of dirhodium
complex from upper right in
Scheme 1 in Sanford paper
DOI:
10.1021/acs.organomet.8b0
0400
Advanced ChemDraw
Drawing Complex 3-D Structures:
• Build the rest of the structure:
• Notice the bond is in front of the top left ring
Insert image of dirhodium
complex from upper right in
Scheme 1 in Sanford paper
DOI:
10.1021/acs.organomet.8b0
0400
Advanced ChemDraw
Drawing Complex 3-D Structures:
• Highlight the bond that’s in front
• Send to back:
Insert image of dirhodium
complex from upper right in
Scheme 1 in Sanford paper
DOI:
10.1021/acs.organomet.8b0
0400
Advanced ChemDraw
Drawing Complex 3-D Structures:
• Add atom names using text function
• Add R groups using bonds and text labels
Insert image of dirhodium
complex from upper right in
Scheme 1 in Sanford paper
DOI:
10.1021/acs.organomet.8b0
0400
Advanced ChemDraw
Drawing Complex 3-D Structures:
• Remove chemical warnings
Insert image of dirhodium
complex from upper right in
Scheme 1 in Sanford paper
DOI:
10.1021/acs.organomet.8b0
0400
Advanced ChemDraw
Drawing Reaction Schemes:
• Make sure everything is lined up
• Target:
Lardy, S. W.; Schmidt, V. A. “Intermolecular Radical Mediated Anti-Markovnikov Alkene Hydroamination Using N‐Hydroxyphthalimide,” J. Am.
Chem. Soc. 2018, 10.1021/jacs.8b06881
Insert image of reaction scheme above table 1 in Schmidt paper
DOI: 10.1021/jacs.8b06881
Advanced ChemDraw
Drawing Reaction Schemes:
• Target:
• Draw components first
• Notice the different fonts.
• Highlight everything and make the font consistent (Arial 10)
Insert image of reaction scheme above table 1 in Schmidt paper
DOI: 10.1021/jacs.8b06881
Advanced ChemDraw
Drawing Reaction Schemes:
• Target:
• Add the arrow
Insert image of reaction scheme above table 1 in Schmidt paper
DOI: 10.1021/jacs.8b06881
Advanced ChemDraw
Drawing Reaction Schemes:
• Target:
• Add the arrow
Insert image of reaction scheme above table 1 in Schmidt paper
DOI: 10.1021/jacs.8b06881
Advanced ChemDraw
Drawing Reaction Schemes:
• Target:
• Line everything up
– It helps to use a guideline that you will later delete
Insert image of reaction scheme above table 1 in Schmidt paper
DOI: 10.1021/jacs.8b06881
Advanced ChemDraw
Drawing Reaction Schemes:
• Target:
• Line everything up
– It helps to use a guideline that you will later delete
• Drag all components so they are centered on the line
– The blue boxes show a center point
Insert image of reaction scheme above table 1 in Schmidt paper
DOI: 10.1021/jacs.8b06881
Advanced ChemDraw
Drawing Reaction Schemes:
• Target:
• See how all components are now centered around the line
• Move the guideline and use it to line up your labels
Insert image of reaction scheme above table 1 in Schmidt paper
DOI: 10.1021/jacs.8b06881
Advanced ChemDraw
Drawing Reaction Schemes:
• Target:
• Remove the guideline
• You can change colors and boldness of specific labels
Insert image of reaction scheme above table 1 in Schmidt paper
DOI: 10.1021/jacs.8b06881
Advanced ChemDraw
Drawing Reaction Schemes:
• Target:
• You can change colors and boldness of specific labels
• Finally, add the highlights using a shape
Insert image of reaction scheme above table 1 in Schmidt paper
DOI: 10.1021/jacs.8b06881
Advanced ChemDraw
Drawing Reaction Schemes:
• Target:
• Finally, add the highlights using a shape
• Send the shapes to the back by right clicking
Insert image of reaction scheme above table 1 in Schmidt paper
DOI: 10.1021/jacs.8b06881
Advanced ChemDraw
Drawing Reaction Schemes:
• Target:
• And you are finished
Insert image of reaction scheme above table 1 in Schmidt paper
DOI: 10.1021/jacs.8b06881
Advanced ChemDraw
Drawing Catalytic Cycles (example with 3 components):
• Start with a circle template
Advanced ChemDraw
Drawing Catalytic Cycles (example with 3 components):
• Add your 3 components
Advanced ChemDraw
Drawing Catalytic Cycles (example with 3 components):
• Draw straight arrows between 3 components
Advanced ChemDraw
Drawing Catalytic Cycles (example with 3 components):
• Bend the arrows
– Hold over the arrow, and click/drag the center dot
– Drag until the arrow is inline with the circle
Advanced ChemDraw
Drawing Catalytic Cycles (example with 3 components):
• Bend the arrows
– Continue with other arrows
Advanced ChemDraw
Drawing Catalytic Cycles (example with 3 components):
• Remove circle template
• Now, the cycle can be finished by adding reagents

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Advanced_Chemdraw_Slides_0..............pptx

  • 1. Advanced Chemdraw Created by S. Chantal E. Stieber, California State Polytechnic University Pomona (sestieber@cpp.edu) and posted on VIPEr (www.ionicviper.org) on February 11, 2019. Copyright S. Chantal E. Stieber, 2019. This work is licensed under the Creative Commons Attribution-NonCommercial-ShareAlike 3.0 Unported License. To view a copy of this license visit http://creativecommons.org/about/license/.
  • 2. Advanced ChemDraw Chemdraw 16 user manual Insert image of Chemdraw user interface from page 4 of the Chemdraw 16.0 user manual.
  • 3. Advanced ChemDraw Mantell, M. A.; Kampf, J. W.; Sanford, M. Improved Synthesis of [CpRRhCl2]2 Complexes, Organometallics, 2018, DOI: 10.1021/acs.organomet.8b00400 Drawing Complex 3-D Structures: • Target complex: Insert image of dirhodium complex from upper right in Scheme 1 in Sanford paper DOI: 10.1021/acs.organomet.8b0 0400
  • 4. Advanced ChemDraw Drawing Complex 3-D Structures: • Start with the ligands that you will distort: Insert image of dirhodium complex from upper right in Scheme 1 in Sanford paper DOI: 10.1021/acs.organomet.8b0 0400
  • 5. Advanced ChemDraw Drawing Complex 3-D Structures: • Select the whole ligand: • Distort it in 3-D Insert image of dirhodium complex from upper right in Scheme 1 in Sanford paper DOI: 10.1021/acs.organomet.8b0 0400
  • 6. Advanced ChemDraw Drawing Complex 3-D Structures: • Add shading: • Adjust the circle as needed: Insert image of dirhodium complex from upper right in Scheme 1 in Sanford paper DOI: 10.1021/acs.organomet.8b0 0400
  • 7. Advanced ChemDraw Drawing Complex 3-D Structures: • Copy/paste first ring • Flip vertically to make second ring: • Remove wedges, rotate, and add shading Insert image of dirhodium complex from upper right in Scheme 1 in Sanford paper DOI: 10.1021/acs.organomet.8b0 0400
  • 8. Advanced ChemDraw Drawing Complex 3-D Structures: • Build the rest of the structure: • Notice the bond is in front of the top left ring Insert image of dirhodium complex from upper right in Scheme 1 in Sanford paper DOI: 10.1021/acs.organomet.8b0 0400
  • 9. Advanced ChemDraw Drawing Complex 3-D Structures: • Highlight the bond that’s in front • Send to back: Insert image of dirhodium complex from upper right in Scheme 1 in Sanford paper DOI: 10.1021/acs.organomet.8b0 0400
  • 10. Advanced ChemDraw Drawing Complex 3-D Structures: • Add atom names using text function • Add R groups using bonds and text labels Insert image of dirhodium complex from upper right in Scheme 1 in Sanford paper DOI: 10.1021/acs.organomet.8b0 0400
  • 11. Advanced ChemDraw Drawing Complex 3-D Structures: • Remove chemical warnings Insert image of dirhodium complex from upper right in Scheme 1 in Sanford paper DOI: 10.1021/acs.organomet.8b0 0400
  • 12. Advanced ChemDraw Drawing Reaction Schemes: • Make sure everything is lined up • Target: Lardy, S. W.; Schmidt, V. A. “Intermolecular Radical Mediated Anti-Markovnikov Alkene Hydroamination Using N‐Hydroxyphthalimide,” J. Am. Chem. Soc. 2018, 10.1021/jacs.8b06881 Insert image of reaction scheme above table 1 in Schmidt paper DOI: 10.1021/jacs.8b06881
  • 13. Advanced ChemDraw Drawing Reaction Schemes: • Target: • Draw components first • Notice the different fonts. • Highlight everything and make the font consistent (Arial 10) Insert image of reaction scheme above table 1 in Schmidt paper DOI: 10.1021/jacs.8b06881
  • 14. Advanced ChemDraw Drawing Reaction Schemes: • Target: • Add the arrow Insert image of reaction scheme above table 1 in Schmidt paper DOI: 10.1021/jacs.8b06881
  • 15. Advanced ChemDraw Drawing Reaction Schemes: • Target: • Add the arrow Insert image of reaction scheme above table 1 in Schmidt paper DOI: 10.1021/jacs.8b06881
  • 16. Advanced ChemDraw Drawing Reaction Schemes: • Target: • Line everything up – It helps to use a guideline that you will later delete Insert image of reaction scheme above table 1 in Schmidt paper DOI: 10.1021/jacs.8b06881
  • 17. Advanced ChemDraw Drawing Reaction Schemes: • Target: • Line everything up – It helps to use a guideline that you will later delete • Drag all components so they are centered on the line – The blue boxes show a center point Insert image of reaction scheme above table 1 in Schmidt paper DOI: 10.1021/jacs.8b06881
  • 18. Advanced ChemDraw Drawing Reaction Schemes: • Target: • See how all components are now centered around the line • Move the guideline and use it to line up your labels Insert image of reaction scheme above table 1 in Schmidt paper DOI: 10.1021/jacs.8b06881
  • 19. Advanced ChemDraw Drawing Reaction Schemes: • Target: • Remove the guideline • You can change colors and boldness of specific labels Insert image of reaction scheme above table 1 in Schmidt paper DOI: 10.1021/jacs.8b06881
  • 20. Advanced ChemDraw Drawing Reaction Schemes: • Target: • You can change colors and boldness of specific labels • Finally, add the highlights using a shape Insert image of reaction scheme above table 1 in Schmidt paper DOI: 10.1021/jacs.8b06881
  • 21. Advanced ChemDraw Drawing Reaction Schemes: • Target: • Finally, add the highlights using a shape • Send the shapes to the back by right clicking Insert image of reaction scheme above table 1 in Schmidt paper DOI: 10.1021/jacs.8b06881
  • 22. Advanced ChemDraw Drawing Reaction Schemes: • Target: • And you are finished Insert image of reaction scheme above table 1 in Schmidt paper DOI: 10.1021/jacs.8b06881
  • 23. Advanced ChemDraw Drawing Catalytic Cycles (example with 3 components): • Start with a circle template
  • 24. Advanced ChemDraw Drawing Catalytic Cycles (example with 3 components): • Add your 3 components
  • 25. Advanced ChemDraw Drawing Catalytic Cycles (example with 3 components): • Draw straight arrows between 3 components
  • 26. Advanced ChemDraw Drawing Catalytic Cycles (example with 3 components): • Bend the arrows – Hold over the arrow, and click/drag the center dot – Drag until the arrow is inline with the circle
  • 27. Advanced ChemDraw Drawing Catalytic Cycles (example with 3 components): • Bend the arrows – Continue with other arrows
  • 28. Advanced ChemDraw Drawing Catalytic Cycles (example with 3 components): • Remove circle template • Now, the cycle can be finished by adding reagents