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uid 288
scaling factor multiple (3)

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This species has a counterpart in the experimental library



Number of atoms 29
Weight 229.0891 amu
Total energy -708.0255 Hartree
Zero-point energy 145.5986 Kcal/mol
Scaling factor multiple (3)
Method UB3LYP
State 2-A"
Solo hydrogens 3
Duo hydrogens 4
Trio hydrogens 0
Quartet hydrogens 4
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)