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uid 273
scaling factor multiple (3)

TransitionsLeft-clk & drag: Zoom; Right-clk: reset

This species has a counterpart in the experimental library



Number of atoms 24
Weight 178.0782 amu
Total energy -538.8436 Hartree
Zero-point energy 123.7528 Kcal/mol
Scaling factor multiple (3)
Method RB3LYP
State 1-A1
Solo hydrogens 0
Duo hydrogens 2
Trio hydrogens 0
Quartet hydrogens 8
Quintet hydrogens 0
CH2 0
CHx 0




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4,233 species present in version 3.20 of the theoretical database (Sep 12, 2019)