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Transitions — Left-clk & drag: Zoom; Right-clk: reset |
Number of atoms | 19 |
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Weight | 129.0704 amu |
Total energy | -385.9523 Hartree |
Zero-point energy | 99.3641 Kcal/mol |
Scaling factor | multiple (3) |
Method | UB3LYP |
State | 2-A |
Solo hydrogens | 0 |
Duo hydrogens | 0 |
Trio hydrogens | 3 |
Quartet hydrogens | 4 |
Quintet hydrogens | 0 |
CH2 | 2 |
CHx | 0 |
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Comment(s)
# int=(grid ultrafine) iop(5/22=1012,5/37=