Chemdraw
Chemdraw
Tutorial 1: Reaction
Schemes
In this tutorial, you will draw the following
(simplified) reaction scheme:
O O
OH
OH
2-propanone 4-hydroxy-4-methyl-2-pentanone
2 moles 1 mole
2-propanone Rx 60%
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Tutorial 1: Reaction Schemes
8. Click the Object menu and make sure there is a
NOTE: The angle used when clicking to add bonds is
check mark next to the Fixed Lengths and Fixed
controlled by the Chain Angle setting in the Drawing
Angles commands. If either command is not
Settings dialog box in the File menu. If this bond angle
checked, select it.
cannot be established, the next smaller and logical bond
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angle is used.
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Tutorial 1: Reaction Schemes
2. Double-click the atom. The hand pointer with a plus sign indicates that
you are in the duplication mode of a selection
tool.
isobutene
w/textbox
100%
4. Close the text box by doing one of the A copy of the structure appears as you begin
following: drag. The original structure remains in its
position. Release the mouse button when the
• Click in an empty area of the window.
copy is clear of the original.
• Click another tool.
Next, you duplicate a structure and then create NOTE: When you create a copy as shown above you can
another structure from the duplicate. drag it anywhere in the document window. If you want the
copy to remain aligned with the original, hold Shift while
Duplicate the structure: dragging.
1. Click the Lasso tool .
The last structure drawn is automatically Modify the duplicated structure:
selected. 1. Click the Solid Bond tool .
2. Point over the Selection Rectangle.
2. Point, in the copied structure, to the atom
shown below and click.
O
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Tutorial 1: Reaction Schemes
Add several bonds to a single atom: Align the structures:
1. Point to the atom shown below. 1. Select the structures.
O O
2. Click the atom three times, allowing a pause
between each click.
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Tutorial 1: Reaction Schemes
3. Click the third arrow from the left in the top Use the Text tool to add line formula or other
row. captions for representing reagents and reactions.
Insert text in the drawing:
1. Click the Text tool .
2. Point above the arrow. A text insertion point
appears as shown below.
SelectArrow
150 dpi O O
O O
OH
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Tutorial 1: Reaction Schemes
3. Point to the center of the OH label. Moving the Use the Text tool to create a caption containing the
cursor slightly right or left will cause either the name and amount of reactant, and then center the
O or the H to be selected. caption under the structure.
1. Click the Text tool .
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O O
OH
2. Point below the first structure.
OH O
4. With the H selected, drag the charge symbol
around the atom to the desired position.
O O
OH
To group objects: O
1. Click a Selection tool, the Lasso or
Marquee tool.
2. Hold Shift and click the arrow, the OH caption,
and the charge symbol.
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Tutorial 1: Reaction Schemes
2. Press the Enter or Return key to insert a new If your captions are not aligned properly beneath
line. the structures you can move them using a selection
tool.
O
1. Click a Selection tool (Lasso or Marquee).
The text box is automatically selected because
it is the last object drawn.
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Tutorial 1: Reaction Schemes
Save and close the document: Delete an atom and its bonds from the ring:
1. From the File menu, choose Save. 1. Click the Eraser tool .
Your document is saved. 2. Point to the atom shown below.
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Tutorial 2: Drawing
an Intermediate
In this tutorial you will draw the following
3. Click the atom.
intermediate structure starting from a ring and then
add arrows with customized shapes using the Pen
tool.
O-
OH
Draw a ring:
1. Click the Cyclohexane Ring tool .
2. Point in the document window. The 3. Click to add a bond.
Cyclohexane cursor appears.
3. Click to add a ring.
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Tutorial 2: Drawing an Intermediate
Add second and third bonds: 2. Drag diagonally downward over the existing
bond to create a double bond.
1. Point to the atom shown below and click to add
another bond.
2. Add a third bond by dragging to make sure it Change the orientation of the double bond:
has the desired orientation: 1. Point to the center of the double bond.
a. Continue pointing to C4.
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Tutorial 2: Drawing an Intermediate
2. Double-click the atom to open a text box. 3. Point near the double bond where you want to
indicate the start of electron flow.
O-
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OH
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Tutorial 2: Drawing an Intermediate
Refine the shape of the arrow: Tutorial 3: Using Rings
1. Point to the handle pointing away from and to
In this tutorial you will draw more complex
the right of the curve. This is a tangent handle
structures by using rings.
that controls the tangent of the curve that it
touches. O
CH
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Tutorial 3: Using Rings
2. Click to fuse another ring. 2. Click to fuse another ring.
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Tutorial 3: Using Rings
4. Click each of the atoms shown below to delete 3. Drag upward to draw a double bond.
the bonds.
Add double bonds to the structure: 1. Point to the center of the upper double bond.
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Tutorial 3: Using Rings
Add a carbon atom label: Save and close the document.
1. Point to the atom shown below. 1. From the File menu, choose Save.
2. From the File menu, choose Close.
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Tutorial 4: Fischer
Projections
This tutorial demonstrates creating a Fischer
projection of glucose (shown below) by drawing a
linear series of bonds. You can also create the same
2. Press the c key on your keyboard. “c” is a
drawing using a template.
Hotkey assigned to the atom label C.
The CH atom label appears with the correct CHO
CH CH 2 OH
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Tutorial 4: Fischer Projections
4. Select a folder in which to save the file. 3. Repeat step 1and step 2 three times to draw a
5. Click Save. total of five bonds.
NOTE: When you drag the pointer along the length of the
bonds, the pointer alternates between an arrow and a cross.
2. Drag downward to draw the second bond. The arrow indicates you are pointing over the center of a
bond, and the cross indicates you are pointing to an atom.
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Tutorial 4: Fischer Projections
Add a horizontal bond in the opposite direction: 2. Continue pointing to C3 and click the atom to
• Continue pointing to C2 and click the atom to add a perpendicular bond in the opposite
add a perpendicular bond in the opposite direction.
direction.
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Tutorial 4: Fischer Projections
Add labels to C1 and C6: 3. Point to C6.
1. Point to C1.
CHO
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Tutorial 4: Fischer Projections
1. Point to the atom shown below. 4. Label the remaining atoms by typing o to label
them with OH. The result should appear as
CHO shown below.
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CHO
H OH
Fischer
H OGlucose H
70%
H OH
H OH
C H 2O H
CH2OH
CH2OH
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Tutorial 4: Fischer Projections
3. Click Paste to paste the information as a Draw a ring:
caption below the structure.
1. Click the Cyclohexane Ring tool .
CHO
2. Point in an empty area of a document window.
H OH
HO H
3. Click to add a ring.
H OH
H OH
CH2OH
C6H12O6
Exact Mass: 180.06
Mol. Wt.: 180.16
m/e: 180.06 (100.0%), 181.07 (7.1%), 182.07 (1.4%) Rotate the ring:
C, 40.00; H, 6.71; O, 53.29
1. From the Edit menu, choose Select All.
Save and close the document:
1. From the File menu, choose Save.
2. From the File menu, choose Close.
Tutorial 5: Perspective
Drawings 2. Point to the upper right corner of the Selection
Rectangle (the Rotation handle).
In this tutorial you will learn how to create a
perspective drawing by drawing the following
α -D-glucose as a Haworth projection.
CH2OH
O
OH
OH OH
OH NOTE: The cursor changes to a curved double-sided arrow
Create a new document using the ChemDraw to indicate the rotation mode of a selection tool is activated.
default style:
3. Drag the Rotation handle to the right about 30
1. From File menu, point to Open Special, and degrees. The amount of rotation is displayed
then choose New Document. on the screen and in the Info window.
2. From the File menu, choose Save As.
3. Type tut5.cdx in the appropriate text box.
4. Select a folder in which to save the file.
5. Click Save.
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Tutorial 5: Perspective Drawings
Even though Fixed Angles is on, the angle is not 4. Point to C1 again.
constrained. The Fixed Angles feature constrains
O
angles only when they are being drawn. For
example, if you created this ring by dragging instead
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Tutorial 5: Perspective Drawings
2. Hold the mouse button and drag upward. Distort the structure to change its aspect ratio to
give the perspective of viewing the structure along
the Z-axis.
1. Click the Lasso tool .
O 2. Point to the Resize handle (lower right corner)
and press the Shift key.
Resize handle
For the downward bond for C5, you must turn
Fixed Lengths off or the bond will be joined to the
upward bond of C3.
You can temporarily disable Fixed Lengths using a NOTE: The cursor changes to a cross with arrows at
modifier key: each end indicating the distortion function of a selection
tool.
1. Point to the atom shown below.
3. Drag upwards until you have distorted the
structure to about 50%, as shown on the screen
O or in the Info window.
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Tutorial 5: Perspective Drawings
2. Type OH, move the pointer to the next atom as The cursor changes to a bold arrow as you
shown, and triple-click to repeat the atom label. point at the bond.
CH2OH
O
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O
OH
OH OH OH
OH
3. Triple-click the remaining atoms (as shown 3. Click to change to the new bond type.
below) to repeat the OH label.
CH2OH
O
O OH
OH
OH OH
OH OH OH
OH 4. Click the Bold Wedge bond tool .
NOTE: If you find it difficult to place the labels 5. Point to each of the bonds shown below.
because of the size of the drawing, choose Magnify from CH2OH
the View menu. O
OH
OH OH
Change the type of the front bonds:
OH
1. Click the Bold Bond tool .
NOTE: If the wedge is pointed in the wrong direction,
2. Point to the center of the bond shown below. click the bond again to flip its orientation.
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Tutorial 5: Perspective Drawings
Save and close the document: Tutorial 6: Newman
1. From the File menu, choose Save.
2. From the File menu, choose Close.
Projections
This tutorial demonstrates how to draw a Newman
projection. You can also create the same drawing
using a template.
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Tutorial 6: Newman Projections
4. Continue pointing at the same atom and click 2. Point to the central atom of the lower
again to add a third bond. fragment.
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In this step, you will use the Orbital tool to draw the
hollow circle that is particular to Newman
Projections rather than an orbital.
1. Click the Orbital tool .
2. Click the unfilled s orbital.
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Tutorial 6: Newman Projections
The size of the orbital is constrained just like Rotate the selection:
bonds. The constraint is based on a percentage
1. Double-click the Rotation handle in the upper
of the Fixed Length setting in the Drawing
right of the Selection Rectangle to open the
Settings dialog box.
Rotate dialog box.
NOTE: Orbitals are not automatically grouped with 2. Type 180 in the text box, select degrees CW,
the closest structure. If you want to group the orbital and then click Rotate.
with the existing structure so you can move them as a
unit, choose Group from the Object menu.
1. Click the Marquee tool . Change the layering of the structure so that the
2. Point above the structure and drag around the selection is in front:
upper fragment to select the three bonds. • From the Object menu, choose Bring to
Front.
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Tutorial 6: Newman Projections
2. Drag the selection until the central atom of the 1. Click the Solid Bond tool .
selection is centered within the orbital. 2. Click in the document window and drag
downward to create the first bond.
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Stereochemistry
This tutorial demonstrates using Stereochemistry
markers and the flip command.
5. Point to the atom shown below and click.
Create a new document.
1. From the File menu, choose New Document.
2. From the File menu, choose Save As.
3. Type tut7.cdx in the appropriate text box.
4. Select a folder in which to save the file. 6. Point to the atom shown below and click twice
to create two bonds.
5. Click Save.
Draw the following structure:
O
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Tutorial 7: Showing Stereochemistry
8. Click the Wedged Bond tool, point to the atom Display the stereochemical markers.
below, and then click.
1. Select the entire structure with the Lasso or
Marquee.
2. From the Object menu, choose Show
Stereochemistry.
The S marker appears.
Add atom labels.
O
1. With the Text tool, click the atom shown
below, and then type NH2 in the text box that
appears. (S)
OH
NH2
3. Select the structure and from the Object menu,
choose Flip Horizontal.
The R marker appears.
O
2. With the Text tool, click the atom shown
below, and then type O in the text box that
appears. (R)
HO
NH2
4. With the structure selected do the following:
Click the Object menu. While holding the
mouse button, press the Alt or Shift+Option
NH2 key and choose Rotate 180° Vertical.
3. With the Text tool, click the atom shown
below, and then type OH in the text box that NH2
appears.
HO
O (R)
O
The Wedged bond becomes hashed and the (R)
stereochemistry is preserved.
NH2
Save and close the document:
1. From the File menu, choose Save.
2. From the File menu, choose Close.
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Tutorial 7: Showing Stereochemistry
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Tutorial 7: Showing Stereochemistry