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Compare Calculated Bonds for O-H

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QCISD(TQ)/aug-cc-pVTZ

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


Values greater than 1.03 are in the 1.03 bin. Values less than 0.94 are in the 0.94 bin.

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0.94 0.95 0.96 0.97 0.98 0.99 1.00 1.01 1.02 1.03
bond lengths (Å)

Summary: (Å)
Average bond length Standard deviation
0.978 0.018

  Species Name Bond Length (Å)
Lowest value BeOH beryllium monohydroxide 0.946
Highest value NOH+ O-protonated nitric oxide 1.019

Calculated Bond lengths
Click on entry for all calculated results.
Species Name Bond Length (Å) Atom1 index Atom2 index
OH- hydroxide anion 0.967 1 2
OH Hydroxyl radical 0.974 1 2
H2O Water 0.961 1 2
    0.961 1 3
H3O+ hydronium cation 0.979 1 2
    0.979 1 3
    0.979 1 4
LiOH lithium hydroxide 0.951 1 3
HO2 Hydroperoxy radical 0.974 1 3
HO2+ Hydroperoxy cation 1.013 1 3
BeOH beryllium monohydroxide 0.946 1 3
NOH Hydroxyimidogen 0.972 2 3
NOH+ O-protonated nitric oxide 1.019 2 3
COH+ Carbon Monoxide, protonated 0.992 2 3
SOH+ Sulfur Monoxide, protonated 0.984 2 3
HOCl+ hypochlorous acid cation 0.992 1 2
NH2OH+ Hydroxylamine cation 0.980 2 3