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Compare Calculated Bonds for O-O

17 01 10 14 40

ROHF/cc-pVDZ

Histogram of Bond lengths (in Å) vs number of species


Values greater than 1.45 are in the 1.45 bin. Values less than 1.05 are in the 1.05 bin.

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1.05 1.10 1.15 1.20 1.25 1.30 1.35 1.40 1.45
bond lengths (Å)

Summary: (Å)
Average bond length Standard deviation
1.232 0.088

  Species Name Bond Length (Å)
Lowest value O2+ diatomic oxygen cation 1.064
Highest value CH2OOH CH2OOH radical 1.386

Calculated Bond lengths
Click on entry for all calculated results.
Species Name Bond Length (Å) Atom1 index Atom2 index
O2- oxygen diatomic anion 1.291 1 2
O2 Oxygen diatomic 1.154 1 2
O2+ diatomic oxygen cation 1.064 1 2
HO2 Hydroperoxy radical 1.307 1 2
HO2+ Hydroperoxy cation 1.196 1 2
H2O2+ Hydrogen peroxide cation 1.245 1 2
LiO2 Lithium dioxide 1.286 2 3
NaO2 Sodium superoxide 1.289 2 3
FOO+ Fluorine dioxide cation 1.113 1 2
ClOO chloroperoxy radical 1.275 2 3
ClOO+ chloroperoxy cation 1.135 2 3
CH3OO methylperoxy radical 1.299 2 3
CH3OO+ methylperoxy cation 1.145 2 3
CH2OOH CH2OOH radical 1.386 2 3
C2H5OO ethylperoxy radical 1.294 3 4