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.<br />

Administrator<br />

b. From the Structure menu, point to<br />

Measurement, and then choose Bond Angles.<br />

NOTE: If the Measurements table appears along side<br />

the Model Explorer, you can stack the windows by<br />

locking the Model Explorer window open and dragging<br />

the Measurements table on top of it.<br />

The information you chose appears in the<br />

Measurements table. The measurements in the<br />

Actual and Optimal columns are nearly<br />

identical. The Actual column represents the<br />

measurements for the model in the active<br />

window. The Optimal measurements (for bond<br />

lengths and bond angles only) represent the<br />

standard measurements in the Bond Stretching<br />

and Angle Bending parameter tables.<br />

Rotate the orientation of the model to obtain a<br />

Newman projection (viewing the model along a<br />

bond.) This orientation helps clarify the<br />

conformations of ethane.<br />

To rotate a methyl group on an ethane model:<br />

1. Click the Trackball tool .<br />

When you mouse over the edges of the model<br />

window, the Rotation Bars appear.<br />

Only the X- and Y-rotation bars are active.<br />

These Rotations bars are always active because<br />

they are not dependent on any atoms being<br />

selected.<br />

2. Click the X-Axis rotation bar and drag to the<br />

right.<br />

As you drag, the status bar shows details about<br />

the rotation.<br />

3. Stop dragging when you have an end-on view<br />

of ethane.<br />

This staggered conformation, where the<br />

hydrogens on adjoining carbons are a<br />

maximum distance from one another (which<br />

represents the global minimum on a potential<br />

energy plot) represents the most stable<br />

conformation of ethane.<br />

Chem3D shows the most common conformation<br />

of a molecule. You can rotate parts of a molecule,<br />

such as a methyl group, to see other conformations.<br />

36 •Chem3D Tutorials <strong>CambridgeSoft</strong><br />

Tutorial 4: Examining Conformations

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