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uid 537
scaling factor multiple (3)

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

This species has a counterpart in the experimental library

Details

Properties

Number of atoms 44
Weight 352.1252 amu
Total energy -1075.308 Hartree
Zero-point energy 221.2592 Kcal/mol
Scaling factor multiple (3)
Method RB3LYP
State ???
Solo hydrogens 2
Duo hydrogens 0
Trio hydrogens 6
Quartet hydrogens 8
Quintet hydrogens 0
CH2 0
CHx 0

Reference(s)

Comment(s)

History


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3,139 species present in version 3.00 of the theoretical database (Aug 18, 2017)