The button HBr DZV (Bond Length) will appear in the box below. Insert information for HBr DZV (Bond Length) here and below.
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The button HBr DZV (HOMO) will appear in the box below. Insert information for HBr DZV (HOMO) here and below.
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The button HBr DZV (LUMO) will appear in the box below. Insert information for HBr DZV (LUMO) here and below.
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The button HBr DZV (PAC) will appear in the box below. Insert information for HBr DZV (PAC) here and below.
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The button HBr DZV (ESP1) will appear in the box below. Insert information for HBr DZV (ESP1) here and below.
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Occupation Number |
Energy (Hartrees) |
Bonding |
Molecular Orbital |
0 |
0.6641 |
nonbonding |
|
0 |
0.1362 |
antibonding |
|
2 |
-0.4349 |
nonbonding |
|
2 |
-0.4349 |
nonbonding |
|
2 |
-0.5758 |
nonbonding |
|
2 |
-1.0317 |
bonding |
|
2 |
-3.1933 |
nonbonding |
|
2 |
-3.1933 |
nonbonding |
|
2 |
-3.2094 |
nonbonding |
|
2 |
-3.2094 |
nonbonding |
|
2 |
-3.2094 |
nonbonding |
|
2 |
-7.4577 |
nonbonding |
|
2 |
-7.4577 |
nonbonding |
|
2 |
-7.4684 |
nonbonding |
|
2 |
-9.7026 |
nonbonding |
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using Jmol 12.2.34
2012-08-09 20:37 on Feb 25, 2013.